DOLASETRON MESYLATE ANHYDROUS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C19H20N2O3.CH4O3S
Molecular Weight	420.479
Optical Activity	NONE
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DOLASETRON MESYLATE ANHYDROUS

Structure Search

SMILES

CS(O)(=O)=O.[H][C@@]12C[C@H](C[C@H]3C[C@@H](C1)C(=O)CN23)OC(=O)C4=CNC5=C4C=CC=C5

InChI

InChIKey=PSGRLCOSIXJUAL-YJPMVUORSA-N

InChI=1S/C19H20N2O3.CH4O3S/c22-18-10-21-12-5-11(18)6-13(21)8-14(7-12)24-19(23)16-9-20-17-4-2-1-3-15(16)17;1-5(2,3)4/h1-4,9,11-14,20H,5-8,10H2;1H3,(H,2,3,4)/t11-,12+,13-,14-;

HIDE SMILES / InChI

Molecular Formula	C19H20N2O3
Molecular Weight	324.3737
Charge	0
Count

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

Molecular Formula	CH4O3S
Molecular Weight	96.106
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 07:32:19 UTC 2023` Edited by `admin` on `Sat Dec 16 07:32:19 UTC 2023`
Record UNII	71YF100S3H
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DOLASETRON MESYLATE ANHYDROUS

Common Name

English

1H-INDOLE-3-CARBOXYLIC ACID, (6R,9AS)-OCTAHYDRO-3-OXO-2,6-METHANO-2H-QUINOLIZIN-8-YL ESTER, REL-, METHANESULFONATE (1:1)

Common Name

English

1H-INDOLE-3-CARBOXYLIC ACID, OCTAHYDRO-3-OXO-2,6-METHANO-2H-QUINOLIZIN-8-YL ESTER, (2.ALPHA.,6.ALPHA.,8.ALPHA.,9A.BETA.)-, MONOMETHANESULFONATE

Common Name

English

DOLASETRON MESILATE

Common Name

English

Dolasetron mesilate [WHO-DD]

Common Name

English

DOLASETRON METHANESULFONATE

Common Name

English

DOLASETRON METHANESULFONATE [MI]

Common Name

English

1H-INDOLE-3-CARBOXYLIC ACID, OCTAHYDRO-3-OXO-2,6-METHANO-2H-QUINOLIZIN-8-YL ESTER, STEREOISOMER, METHANESULFONATE (1:1)

Common Name

English

Code System Code Type Description

MERCK INDEX

m4728