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

Details

Stereochemistry ACHIRAL
Molecular Formula C16H24N2O4
Molecular Weight 308.3728
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2-(DIPROPYLAMINO)ETHYL)-6-NITROBENZENEACETIC ACID

SMILES

CCCN(CCC)CCC1=CC=CC(=C1CC(O)=O)[N+]([O-])=O

InChI

InChIKey=PBMNGLVZPSNABM-UHFFFAOYSA-N
InChI=1S/C16H24N2O4/c1-3-9-17(10-4-2)11-8-13-6-5-7-15(18(21)22)14(13)12-16(19)20/h5-7H,3-4,8-12H2,1-2H3,(H,19,20)

HIDE SMILES / InChI

Approval Year

Name Type Language
2-(2-(DIPROPYLAMINO)ETHYL)-6-NITROBENZENEACETIC ACID
Systematic Name English
OPEN RING NITRO DERIVATIVE [USP IMPURITY]
Common Name English
OPEN RING NITRO DERIVATIVE
Common Name English
BENZENEACETIC ACID, 2-(2-(DIPROPYLAMINO)ETHYL)-6-NITRO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID201217953
Created by admin on Sat Dec 16 14:42:58 GMT 2023 , Edited by admin on Sat Dec 16 14:42:58 GMT 2023
PRIMARY
FDA UNII
CLZ9O8P1E5
Created by admin on Sat Dec 16 14:42:58 GMT 2023 , Edited by admin on Sat Dec 16 14:42:58 GMT 2023
PRIMARY
PUBCHEM
13530900
Created by admin on Sat Dec 16 14:42:58 GMT 2023 , Edited by admin on Sat Dec 16 14:42:58 GMT 2023
PRIMARY
CAS
720656-64-4
Created by admin on Sat Dec 16 14:42:58 GMT 2023 , Edited by admin on Sat Dec 16 14:42:58 GMT 2023
PRIMARY