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6-nitro-4,5-dihydrobenzo[a]pyrene

6-nitro-4,5-dihydrobenzo[a]pyrene

Systemtic Name:6-nitro-4,5-dihydrobenzo[a]pyrene
Openeye Name:6-nitro-4,5-dihydrobenzo[a]pyrene
CAS Name:6-nitro-4,5-dihydrobenzo[a]pyrene
IUPAC Name:6-nitro-4,5-dihydrobenzo[a]pyrene
Traditional Name:6-nitro-4,5-dihydrobenzo[a]pyrene
Formula: C20H13NO2
MolecularWeight: 299.32272
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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C3C4=C2C5=C(C=CC=C51)C=C4)[N+](=O)[O-]


Isomeric SMILES

C1CC2=C(C3=CC=CC=C3C4=C2C5=C(C=CC=C51)C=C4)[N+](=O)[O-]


InChI

InChI=1S/C20H13NO2/c22-21(23)20-16-7-2-1-6-14(16)15-10-8-12-4-3-5-13-9-11-17(20)19(15)18(12)13/h1-8,10H,9,11H2


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