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1-nitrobenzo[a]pyren-8-ol

1-nitrobenzo[a]pyren-8-ol

Systemtic Name:1-nitrobenzo[a]pyren-8-ol
Openeye Name:1-nitrobenzo[a]pyren-8-ol
CAS Name:1-nitro-8-benzo[a]pyrenol
IUPAC Name:1-nitrobenzo[a]pyren-8-ol
Traditional Name:1-nitrobenzo[a]pyren-8-ol
Formula: C20H11NO3
MolecularWeight: 313.30624
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC3=C(C=CC(=C3)O)C4=C2C5=C1C=CC(=C5C=C4)[N+](=O)[O-]


Isomeric SMILES

C1=CC2=CC3=C(C=CC(=C3)O)C4=C2C5=C1C=CC(=C5C=C4)[N+](=O)[O-]


InChI

InChI=1S/C20H11NO3/c22-14-4-5-15-13(10-14)9-12-2-1-11-3-8-18(21(23)24)17-7-6-16(15)20(12)19(11)17/h1-10,22H


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