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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H22ClN3O4
Molecular Weight 415.87
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Chloro-N-[(1S,2R)-2-hydroxy-3-[(methoxymethyl)amino]-3-oxo-1-(phenylmethyl)propyl]-1H-indole-2-carboxamide

SMILES

COCNC(=O)[C@H](O)[C@H](CC1=CC=CC=C1)NC(=O)C2=CC3=C(N2)C=CC(Cl)=C3

InChI

InChIKey=FAKGUYOEMJMLCN-PKOBYXMFSA-N
InChI=1S/C21H22ClN3O4/c1-29-12-23-21(28)19(26)17(9-13-5-3-2-4-6-13)25-20(27)18-11-14-10-15(22)7-8-16(14)24-18/h2-8,10-11,17,19,24,26H,9,12H2,1H3,(H,23,28)(H,25,27)/t17-,19+/m0/s1

HIDE SMILES / InChI

Molecular Formula C21H22ClN3O4
Molecular Weight 415.87
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 Wed Apr 02 11:19:35 GMT 2025
Edited
by admin
on Wed Apr 02 11:19:35 GMT 2025
Record UNII
BA7WG2WD2H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-Chloro-N-[(1S,2R)-2-hydroxy-3-[(methoxymethyl)amino]-3-oxo-1-(phenylmethyl)propyl]-1H-indole-2-carboxamide
Systematic Name English
1H-Indole-2-carboxamide, 5-chloro-N-[(1S,2R)-2-hydroxy-3-[(methoxymethyl)amino]-3-oxo-1-(phenylmethyl)propyl]-
Preferred Name English
Code System Code Type Description
FDA UNII
BA7WG2WD2H
Created by admin on Wed Apr 02 11:19:35 GMT 2025 , Edited by admin on Wed Apr 02 11:19:35 GMT 2025
PRIMARY
PUBCHEM
10194536
Created by admin on Wed Apr 02 11:19:35 GMT 2025 , Edited by admin on Wed Apr 02 11:19:35 GMT 2025
PRIMARY
CAS
362521-65-1
Created by admin on Wed Apr 02 11:19:35 GMT 2025 , Edited by admin on Wed Apr 02 11:19:35 GMT 2025
PRIMARY