U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry RACEMIC
Molecular Formula C16H13N3O
Molecular Weight 263.2939
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-Oxo Epinastine

SMILES

NC1=NCC2N1C3=CC=CC=C3C(=O)C4=CC=CC=C24

InChI

InChIKey=ZLEUIRBHHWJTHP-UHFFFAOYSA-N
InChI=1S/C16H13N3O/c17-16-18-9-14-10-5-1-2-6-11(10)15(20)12-7-3-4-8-13(12)19(14)16/h1-8,14H,9H2,(H2,17,18)

HIDE SMILES / InChI

Approval Year

Name Type Language
9-Oxo Epinastine
Common Name English
3-amino-2,4-diazatetracyclo[12.4.0.0{2,6}.0{7,12}]octadeca-1(14),3,7,9,11,15,17-heptaen-13-one
Systematic Name English
9H-Dibenz[c,f]imidazo[1,5-a]azepin-9-one, 3-amino-1,13b-dihydro-
Systematic Name English
3-Amino-1,13b-dihydro-9H-dibenz[c,f]imidazo[1,5-a]azepin-9-one
Systematic Name English
Code System Code Type Description
CAS
745761-19-7
Created by admin on Sat Dec 16 19:55:24 GMT 2023 , Edited by admin on Sat Dec 16 19:55:24 GMT 2023
PRIMARY
FDA UNII
AU8TWP2FKR
Created by admin on Sat Dec 16 19:55:24 GMT 2023 , Edited by admin on Sat Dec 16 19:55:24 GMT 2023
PRIMARY
PUBCHEM
71306710
Created by admin on Sat Dec 16 19:55:24 GMT 2023 , Edited by admin on Sat Dec 16 19:55:24 GMT 2023
PRIMARY