MONTELUKAST ALCOHOL

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H28ClNO2
Molecular Weight	457.991
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(O)C1=CC=CC=C1CC[C@H](O)C2=CC(\C=C\C3=CC=C4C=CC(Cl)=CC4=N3)=CC=C2

InChI

InChIKey=ZSHIDKYITZZTLA-FCPABOFRSA-N

InChI=1S/C29H28ClNO2/c1-29(2,33)26-9-4-3-7-21(26)13-17-28(32)23-8-5-6-20(18-23)10-15-25-16-12-22-11-14-24(30)19-27(22)31-25/h3-12,14-16,18-19,28,32-33H,13,17H2,1-2H3/b15-10+/t28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C29H28ClNO2
Molecular Weight	457.991
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 16:26:32 GMT 2025` Edited by `admin` on `Tue Apr 01 16:26:32 GMT 2025`
Record UNII	CA9LM1I3YM
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MONTELUKAST ALCOHOL

Common Name

English

(.ALPHA.S)-.ALPHA.-(3-((1E)-2-(7-CHLORO-2-QUINOLINYL)ETHENYL)PHENYL)-2-(1-HYDROXY-1-METHYLETHYL)BENZENEPROPANOL

Preferred Name

English

MONTELUKAST (3S)-HYDROXY PROPANOL

Common Name

English

(S)-1-(3-((E)-2-(7-CHLORO-2-QUINOLINYL)ETHENYL)PHENYL)-3-(2-(1-HYDROXY-1-METHYLETHYL)PHENYL)-1-PROPANOL

Common Name

English

BENZENEPROPANOL, .ALPHA.-(3-((1E)-2-(7-CHLORO-2-QUINOLINYL)ETHENYL)PHENYL)-2-(1-HYDROXY-1-METHYLETHYL)-, (.ALPHA.S)-

Common Name

English

2-(2-(3(S)-(3-(7-CHLORO-2-QUINOLINYL)ETHENYL)PHENYL)-3-HYDROXYPROPYL)PHENYL-2-PROPANOL

Common Name

English

2-(2-(3(S)-(3-(2-(7-CHLORO-2-QUINOLINYL)ETHENYL)PHENYL)-3-HYDROXYPROPYL)PHENYL)-2-PROPANOL

Systematic Name

English

Code System Code Type Description

CAS

287930-77-2