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2-nitrobenzo[a]pyrene

2-nitrobenzo[a]pyrene

Systemtic Name:2-nitrobenzo[a]pyrene
Openeye Name:2-nitrobenzo[a]pyrene
CAS Name:2-nitrobenzo[a]pyrene
IUPAC Name:2-nitrobenzo[a]pyrene
Traditional Name:2-nitrobenzo[a]pyrene
Formula: C20H11NO2
MolecularWeight: 297.30684
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)[N+](=O)[O-]


Isomeric SMILES

C1=CC=C2C3=C4C(=CC2=C1)C=CC5=CC(=CC(=C54)C=C3)[N+](=O)[O-]


InChI

InChI=1S/C20H11NO2/c22-21(23)16-10-14-6-5-13-9-12-3-1-2-4-17(12)18-8-7-15(11-16)19(14)20(13)18/h1-11H


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