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Details

Stereochemistry ACHIRAL
Molecular Formula C20H15NO2
Molecular Weight 301.3386
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Nitro-9,10,11,12-tetrahydrobenzo[e]pyrene

SMILES

[O-][N+](=O)C1=C2C=CC=C3C4=C(CCCC4)C5=CC=CC(=C1)C5=C23

InChI

InChIKey=IPLPTZVDWUUJQN-UHFFFAOYSA-N
InChI=1S/C20H15NO2/c22-21(23)18-11-12-5-3-8-15-13-6-1-2-7-14(13)16-9-4-10-17(18)20(16)19(12)15/h3-5,8-11H,1-2,6-7H2

HIDE SMILES / InChI

Molecular Formula C20H15NO2
Molecular Weight 301.3386
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:47:04 GMT 2025
Edited
by admin
on Mon Mar 31 22:47:04 GMT 2025
Record UNII
5UEB44673C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-Nitro-9,10,11,12-tetrahydrobenzo[e]pyrene
Systematic Name English
9,10,11,12-Tetrahydro-4-nitrobenzo[e]pyrene
Preferred Name English
Benzo[e]pyrene, 9,10,11,12-tetrahydro-4-nitro-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70159190
Created by admin on Mon Mar 31 22:47:04 GMT 2025 , Edited by admin on Mon Mar 31 22:47:04 GMT 2025
PRIMARY
PUBCHEM
154457
Created by admin on Mon Mar 31 22:47:04 GMT 2025 , Edited by admin on Mon Mar 31 22:47:04 GMT 2025
PRIMARY
FDA UNII
5UEB44673C
Created by admin on Mon Mar 31 22:47:04 GMT 2025 , Edited by admin on Mon Mar 31 22:47:04 GMT 2025
PRIMARY
CAS
134998-79-1
Created by admin on Mon Mar 31 22:47:04 GMT 2025 , Edited by admin on Mon Mar 31 22:47:04 GMT 2025
PRIMARY