Zolunicant hydrochloride

Details

Stereochemistry	RACEMIC
Molecular Formula	C22H28N2O3.ClH
Molecular Weight	404.93
Optical Activity	( + / - )
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[H][C@@]12[C@@H](CCOC)C[C@H]3C[N@@]1CCC4=C(NC5=CC=CC=C45)[C@@]2(C3)C(=O)OC

InChI

InChIKey=CVBFKKVQGICEBT-BWXWGAIDSA-N

InChI=1S/C22H28N2O3.ClH/c1-26-10-8-15-11-14-12-22(21(25)27-2)19-17(7-9-24(13-14)20(15)22)16-5-3-4-6-18(16)23-19;/h3-6,14-15,20,23H,7-13H2,1-2H3;1H/t14-,15+,20+,22-;/m1./s1

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	C22H28N2O3
Molecular Weight	368.4693
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	3 / 4
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:47:45 UTC 2023` Edited by `admin` on `Sat Dec 16 09:47:45 UTC 2023`
Record UNII	LN5K0F4GJF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Zolunicant hydrochloride

Official Name

English

ZOLUNICANT HYDROCHLORIDE [USAN]

Common Name

English

(±)-18-MC HYDROCHLORIDE

Code

English

(1RS,13RS,17SR)-1-(METHOXYCARBONYL)-17-(2-METHOXYETHYL)-3,13-DIAZAPENTACYCLO(13.3.1.0^2,10^.0^4,9^.0^13,18^)NONADECA-2(10),4,6,8-TETRAEN-13-IUM CHLORIDE

Systematic Name

English

RAC-18-METHOXYCORONARIDINE HYDROCHLORIDE

Common Name

English

18-METHOXYCORONARIDINE HYDROCHLORIDE, (±)-

Common Name

English

6,9-METHANO-5H-PYRIDO(1',2':1,2)AZEPINO(4,5-B)INDOLE-6(6AH)-CARBOXYLIC ACID, 7,8,9,10,12,13-HEXAHYDRO-7-(2-METHOXYETHYL)-, METHYL ESTER, HYDROCHLORIDE (1:1), (6R,6AR,7S,9S,11R)-REL-

Systematic Name

English

methyl (6s,7r,9r,11s)-7-(2-methoxyethyl)-7,8,9,10,12,13-hexahydro-5H-6,9- methanopyrido[1',2':1,2]azepino[4,5-b]indole-6(6aH)-carboxylate, chloride salt (1:1)

Systematic Name

English

Code System Code Type Description

FDA UNII

LN5K0F4GJF