9-phenanthren-9-ylbenzo[a]pyrene

Systemtic Name: 9-phenanthren-9-ylbenzo[a]pyrene Openeye Name: 9-(9-phenanthryl)benzo[a]pyrene CAS Name: 9-(9-phenanthrenyl)benzo[a]pyrene IUPAC Name: 9-phenanthren-9-ylbenzo[a]pyrene Traditional Name: 9-(9-phenanthryl)benzo[a]pyrene Formula: C34H20 MolecularWeight: 428.5226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC5=C(C=C4)C=C6C=CC7=C8C6=C5C=CC8=CC=C7

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=CC5=C(C=C4)C=C6C=CC7=C8C6=C5C=CC8=CC=C7

InChI

InChI=1S/C34H20/c1-2-9-27-23(6-1)19-31(29-11-4-3-10-28(27)29)25-14-13-24-18-26-15-12-21-7-5-8-22-16-17-30(32(24)20-25)34(26)33(21)22/h1-20H