VOCACAPSAICIN HYDROCHLORIDE

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H41N3O4.ClH
Molecular Weight	496.082
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of VOCACAPSAICIN HYDROCHLORIDE

Structure Search

SMILES

Cl.CNCC1CCCCN1C(=O)OC2=CC=C(CNC(=O)CCCC\C=C\C(C)C)C=C2OC

InChI

InChIKey=WOJDHHAJADLOCK-RVDQCCQOSA-N

InChI=1S/C26H41N3O4.ClH/c1-20(2)11-7-5-6-8-13-25(30)28-18-21-14-15-23(24(17-21)32-4)33-26(31)29-16-10-9-12-22(29)19-27-3;/h7,11,14-15,17,20,22,27H,5-6,8-10,12-13,16,18-19H2,1-4H3,(H,28,30);1H/b11-7+;

HIDE SMILES / InChI

Molecular Formula	C26H41N3O4
Molecular Weight	459.6214
Charge	0
Count

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

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 14:11:29 UTC 2023` Edited by `admin` on `Sat Dec 16 14:11:29 UTC 2023`
Record UNII	0892508P5Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

VOCACAPSAICIN HYDROCHLORIDE

Official Name

English

1-PIPERIDINECARBOXYLIC ACID, 2-((METHYLAMINO)METHYL)-, 2-METHOXY-4-((((6E)-8-METHYL-1-OXO-6-NONEN-1-YL)AMINO)METHYL)PHENYL ESTER, HYDROCHLORIDE (1:1)

Systematic Name

English

CA-008 HYDROCHLORIDE

Code

English

2-Methoxy-4-{[(6E)-8-methylnon-6-enamido]methyl}phenyl (2RS)-2-[(methylamino)methyl]piperidine-1-carboxylate, hydrochloride (1:1)

Systematic Name

English

VOCACAPSAICIN HYDROCHLORIDE [USAN]

Common Name

English

Code System Code Type Description

PUBCHEM

132169136