CHF-2819, (1R)-(DEMETHYL)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H25N3O3.ClH
Molecular Weight	403.902
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

Cl.[H][C@@]12NC3=CC=C(OC(=O)NC4=C(CC)C=CC=C4)C=C3[C@]1(C)CC[N@@+]2(C)[O-]

InChI

InChIKey=CVDHRWXJJRBPFA-FKXUWVMKSA-N

InChI=1S/C21H25N3O3.ClH/c1-4-14-7-5-6-8-17(14)23-20(25)27-15-9-10-18-16(13-15)21(2)11-12-24(3,26)19(21)22-18;/h5-10,13,19,22H,4,11-12H2,1-3H3,(H,23,25);1H/t19-,21-,24+;/m0./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	C21H25N3O3
Molecular Weight	367.4415
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:43:50 UTC 2023` Edited by `admin` on `Sat Dec 16 08:43:50 UTC 2023`
Record UNII	19OP2S99RQ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHF-2819, (1R)-(DEMETHYL)-

Common Name

English

CARBAMIC ACID, N-(2-ETHYLPHENYL)-, (1R,3AS,8AS)-1,2,3,3A,8,8A-HEXAHYDRO-1,3A-DIMETHYL-1-OXIDOPYRROLO(2,3-B)INDOL-5-YL ESTER, HYDROCHLORIDE (1:1)

Systematic Name

English

Code System Code Type Description

DRUG BANK

DBSALT002858

Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023

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PUBCHEM

119058385

Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023

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CAS

412044-92-9

Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023

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FDA UNII

19OP2S99RQ

Created by admin on Sat Dec 16 08:43:51 UTC 2023 , Edited by admin on Sat Dec 16 08:43:51 UTC 2023

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