ISALMADOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C22H27NO4
Molecular Weight	369.4541
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CN(C)C[C@H]1CCCC[C@]1(O)C2=CC(OC(=O)C3=CC=CC=C3O)=CC=C2

InChI

InChIKey=OLXCPJRIWXIFTH-VGSWGCGISA-N

InChI=1S/C22H27NO4/c1-23(2)15-17-8-5-6-13-22(17,26)16-9-7-10-18(14-16)27-21(25)19-11-3-4-12-20(19)24/h3-4,7,9-12,14,17,24,26H,5-6,8,13,15H2,1-2H3/t17-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H27NO4
Molecular Weight	369.4541
Charge	0
Count

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

Description
Sources: http://apps.who.int/medicinedocs/documents/s14176e/s14176e.pdf

ISALMADOL is an analgesic agent.

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:37:59 GMT 2023` Edited by `admin` on `Fri Dec 15 18:37:59 GMT 2023`
Record UNII	6N60J342OF
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISALMADOL

Official Name

English

3-((1RS,2RS)-2-((DIMETHYLAMINO)METHYL)-1-HYDROXYCYCLOHEXYL)PHENYL 2-HYDROXYBENZOATE

Systematic Name

English

BENZOIC ACID, 2-HYDROXY-, 3-((1R,2R)-2-((DIMETHYLAMINO)METHYL)-1-HYDROXYCYCLOHEXYL)PHENYL ESTER, REL-

Common Name

English

isalmadol [INN]

Common Name

English

Code System Code Type Description

FDA UNII

6N60J342OF