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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H9N3O2
Molecular Weight 227.2188
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-Methyl-6-nitro-9H-pyrido[3,4-b]indole

SMILES

CC1=NC=CC2=C1NC3=C2C=C(C=C3)[N+]([O-])=O

InChI

InChIKey=KHTDXKAUSUJSQZ-UHFFFAOYSA-N
InChI=1S/C12H9N3O2/c1-7-12-9(4-5-13-7)10-6-8(15(16)17)2-3-11(10)14-12/h2-6,14H,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-527515
Preferred Name English
1-Methyl-6-nitro-9H-pyrido[3,4-b]indole
Systematic Name English
9H-Pyrido(3,4-b)indole, 1-methyl-6-nitro-
Systematic Name English
6-Nitroharman
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80191682
Created by admin on Tue Apr 01 20:29:37 GMT 2025 , Edited by admin on Tue Apr 01 20:29:37 GMT 2025
PRIMARY
PUBCHEM
5386115
Created by admin on Tue Apr 01 20:29:37 GMT 2025 , Edited by admin on Tue Apr 01 20:29:37 GMT 2025
PRIMARY
NSC
527515
Created by admin on Tue Apr 01 20:29:37 GMT 2025 , Edited by admin on Tue Apr 01 20:29:37 GMT 2025
PRIMARY
FDA UNII
X5U8FJC62M
Created by admin on Tue Apr 01 20:29:37 GMT 2025 , Edited by admin on Tue Apr 01 20:29:37 GMT 2025
PRIMARY
CAS
38314-91-9
Created by admin on Tue Apr 01 20:29:37 GMT 2025 , Edited by admin on Tue Apr 01 20:29:37 GMT 2025
PRIMARY