D-517 HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H36N2O4.ClH
Molecular Weight	477.036
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.COC1=CC=C(CCN(C)CCC(C#N)(C(C)C)C2=CC(OC)=C(OC)C=C2)C=C1OC

InChI

InChIKey=FVLOHGQKBZSXNK-UHFFFAOYSA-N

InChI=1S/C26H36N2O4.ClH/c1-19(2)26(18-27,21-9-11-23(30-5)25(17-21)32-7)13-15-28(3)14-12-20-8-10-22(29-4)24(16-20)31-6;/h8-11,16-17,19H,12-15H2,1-7H3;1H

HIDE SMILES / InChI

Molecular Formula	ClH
Molecular Weight	36.461
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C26H36N2O4
Molecular Weight	440.575
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 11:09:56 UTC 2023` Edited by `admin` on `Sat Dec 16 11:09:56 UTC 2023`
Record UNII	3VK59M207R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

D-517 HYDROCHLORIDE

Common Name

English

VERAPAMIL RELATED COMPOUND B

Common Name

English

VENLAFAXINE RELATED COMPOUND B

Common Name

English

BENZENEACETONITRILE, .ALPHA.-(2-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMINO)ETHYL)-3,4-DIMETHOXY-.ALPHA.-(1-METHYLETHYL)-, HYDROCHLORIDE (1:1)

Systematic Name

English

D-517 HYDROCHLORIDE, (RS)-

Code

English

ALPHA-(2-((2-(3,4-DIMETHOXYPHENYL)-ETHYL)METHYLAMINO)ETHYL)-3,4-DIMETHOXY-ALPHA-(1-METHYLETHYL)-BENZENEACETONITRILE MONOHYDROCHLORIDE

Systematic Name

English

VERAPAMIL RELATED COMPOUND B [USP-RS]

Common Name

English

VENLAFAXINE RELATED COMPOUND B [USP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

3VK59M207R

Created by admin on Sat Dec 16 11:09:57 UTC 2023 , Edited by admin on Sat Dec 16 11:09:57 UTC 2023

PRIMARY

CAS

1794-55-4

Created by admin on Sat Dec 16 11:09:57 UTC 2023 , Edited by admin on Sat Dec 16 11:09:57 UTC 2023

PRIMARY

RS_ITEM_NUM

1711406

Created by admin on Sat Dec 16 11:09:57 UTC 2023 , Edited by admin on Sat Dec 16 11:09:57 UTC 2023

PRIMARY

PUBCHEM

71315155

Created by admin on Sat Dec 16 11:09:57 UTC 2023 , Edited by admin on Sat Dec 16 11:09:57 UTC 2023

PRIMARY

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