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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 3-NITRO-7,8,9,10-TETRAHYDROBENZO(A)PYRENE

SMILES

[O-][N+](=O)C1=C2C=CC3=CC4=C(CCCC4)C5=CC=C(C=C1)C2=C35

InChI

InChIKey=GMGGMXJWIUFFNB-UHFFFAOYSA-N
InChI=1S/C20H15NO2/c22-21(23)18-10-7-12-5-8-16-15-4-2-1-3-13(15)11-14-6-9-17(18)19(12)20(14)16/h5-11H,1-4H2

HIDE SMILES / InChI

Approval Year

Unknown
139594
Name Type Language
3-NITRO-7,8,9,10-TETRAHYDROBENZO(A)PYRENE
Systematic Name English
BENZO(A)PYRENE, 7,8,9,10-TETRAHYDRO-3-NITRO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10237168
Created by admin on Sat Dec 16 18:39:45 GMT 2023 , Edited by admin on Sat Dec 16 18:39:45 GMT 2023
PRIMARY
CAS
88598-57-6
Created by admin on Sat Dec 16 18:39:45 GMT 2023 , Edited by admin on Sat Dec 16 18:39:45 GMT 2023
PRIMARY
PUBCHEM
55842
Created by admin on Sat Dec 16 18:39:45 GMT 2023 , Edited by admin on Sat Dec 16 18:39:45 GMT 2023
PRIMARY
FDA UNII
9SX7ZJ6UJ6
Created by admin on Sat Dec 16 18:39:45 GMT 2023 , Edited by admin on Sat Dec 16 18:39:45 GMT 2023
PRIMARY
NIH
NCATS
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