(.ALPHA.R,.BETA.S)-.ALPHA.-(3-CHLOROPHENYL)-.ALPHA.-METHYL-.BETA.-PHENYL-2-PYRIDINEETHANOL, (±)-

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C20H18ClNO
Molecular Weight	323.816
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of (.ALPHA.R,.BETA.S)-.ALPHA.-(3-CHLOROPHENYL)-.ALPHA.-METHYL-.BETA.-PHENYL-2-PYRIDINEETHANOL, (±)-

Structure Search

SMILES

C[C@@](O)([C@@H](C1=CC=CC=C1)C2=NC=CC=C2)C3=CC=CC(Cl)=C3

InChI

InChIKey=SIQJKXNPTOTGHR-PMACEKPBSA-N

InChI=1S/C20H18ClNO/c1-20(23,16-10-7-11-17(21)14-16)19(15-8-3-2-4-9-15)18-12-5-6-13-22-18/h2-14,19,23H,1H3/t19-,20-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C20H18ClNO
Molecular Weight	323.816
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 17:46:39 GMT 2025` Edited by `admin` on `Mon Mar 31 17:46:39 GMT 2025`
Record UNII	CJM37CH69Z
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-174273

Preferred Name

English

(.ALPHA.R,.BETA.S)-.ALPHA.-(3-CHLOROPHENYL)-.ALPHA.-METHYL-.BETA.-PHENYL-2-PYRIDINEETHANOL, (±)-

Systematic Name

English

2-PYRIDINEETHANOL, .ALPHA.-(3-CHLOROPHENYL)-.ALPHA.-METHYL-.BETA.-PHENYL-, (.ALPHA.R,.BETA.S)-REL-

Systematic Name

English

Code System Code Type Description

CAS

22199-90-2

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

SUPERSEDED

EPA CompTox

DTXSID20930678

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

PRIMARY

CAS

13997-39-2

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

NON-SPECIFIC STEREOCHEMISTRY

NSC

174273

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

PRIMARY

CAS

59980-71-1

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

PRIMARY

PUBCHEM

92445696

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

PRIMARY

FDA UNII

CJM37CH69Z

Created by admin on Mon Mar 31 17:46:39 GMT 2025 , Edited by admin on Mon Mar 31 17:46:39 GMT 2025

PRIMARY