MLN-3897

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C32H37ClN2O3
Molecular Weight	533.101
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(C)(O)C1=CC2=C(OCC3=NC=CC=C3\C2=C/CCN4CC[C@](O)(C5=CC=C(Cl)C=C5)C(C)(C)C4)C=C1

InChI

InChIKey=ZGFJFBOLVLFLLN-MOLVWPNASA-N

InChI=1S/C32H37ClN2O3/c1-30(2)21-35(18-15-32(30,37)22-9-12-24(33)13-10-22)17-6-8-25-26-7-5-16-34-28(26)20-38-29-14-11-23(19-27(25)29)31(3,4)36/h5,7-14,16,19,36-37H,6,15,17-18,20-21H2,1-4H3/b25-8+/t32-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

AVE-9897

Preferred Name

English

MLN-3897

Common Name

English

(4S)-4-(4-CHLOROPHENYL)-1-((3E)-3-(9-(1-HYDROXY-1-METHYL-ETHYL)-5H-(1)BENZOXEPINO(3,4-B)PYRIDIN-11-YLIDENE)PROPYL)-3,3-DIMETHYL-PIPERIDIN-4-OL

Systematic Name

English

BENZOXEPINO(3,4-B)PYRIDINE-7-METHANOL, 5-(3-((4S)-4-(4-CHLOROPHENYL)-4-HYDROXY-3,3-DIMETHYL-1-PIPERIDINYL)PROPYLIDENE)-5,11-DIHYDRO-.ALPHA.,.ALPHA.-DIMETHYL-

Systematic Name

English

Code System Code Type Description

FDA UNII

50SF8H9DCZ

Created by admin on Wed Apr 02 10:00:33 GMT 2025 , Edited by admin on Wed Apr 02 10:00:33 GMT 2025

PRIMARY

PUBCHEM

11527774

Created by admin on Wed Apr 02 10:00:33 GMT 2025 , Edited by admin on Wed Apr 02 10:00:33 GMT 2025

PRIMARY

CAS

849105-26-6

Created by admin on Wed Apr 02 10:00:33 GMT 2025 , Edited by admin on Wed Apr 02 10:00:33 GMT 2025

PRIMARY

ACTIVE MOIETY


					50SF8H9DCZ

MLN-3897

SALT/SOLVATE (PARENT)


					RU8V7KXI4Y

MLN-3897 CITRATE