Olopatadine Hydrochloride, (E)-

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H23NO3.ClH
Molecular Weight	373.873
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure of Olopatadine Hydrochloride, (E)-

Structure Search

SMILES

Cl.CN(C)CC\C=C1/C2=CC=CC=C2COC3=CC=C(CC(O)=O)C=C13

InChI

InChIKey=HVRLZEKDTUEKQH-JUIXXEQESA-N

InChI=1S/C21H23NO3.ClH/c1-22(2)11-5-8-18-17-7-4-3-6-16(17)14-25-20-10-9-15(12-19(18)20)13-21(23)24;/h3-4,6-10,12H,5,11,13-14H2,1-2H3,(H,23,24);1H/b18-8+;

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	C21H23NO3
Molecular Weight	337.4122
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	1
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 20:18:48 UTC 2023` Edited by `admin` on `Sat Dec 16 20:18:48 UTC 2023`
Record UNII	B5XL4FL7QZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Olopatadine Hydrochloride, (E)-

Common Name

English

(E)-Olopatadine Hydrochloride

Common Name

English

2-[(11E)-11-(3-dimethylaminopropylidene)-6H-benzo[c][2]benzoxepin-2-yl]acetic acid hydrochloride

Systematic Name

English

(E)-2-(11-(3-(dimethylamino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-2-yl)acetic acid hydrochloride

Systematic Name

English

Dibenz[b,e]oxepin-2-acetic acid, 11-[3-(dimethylamino)propylidene]-6,11-dihydro-, hydrochloride (1:1), (11E)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

21893738

Created by admin on Sat Dec 16 20:18:49 UTC 2023 , Edited by admin on Sat Dec 16 20:18:49 UTC 2023

PRIMARY

CAS

949141-22-4

Created by admin on Sat Dec 16 20:18:49 UTC 2023 , Edited by admin on Sat Dec 16 20:18:49 UTC 2023

PRIMARY

FDA UNII

B5XL4FL7QZ

Created by admin on Sat Dec 16 20:18:49 UTC 2023 , Edited by admin on Sat Dec 16 20:18:49 UTC 2023

PRIMARY

Related Record Type Details


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OLOPATADINE, (E)-

PARENT -> SALT/SOLVATE

Amount: