3-(4-butylphenyl)-2-naphthalen-1-yl-1-phenyl-benzo[f]isoindole-4,9-dione

Systemtic Name: 3-(4-butylphenyl)-2-naphthalen-1-yl-1-phenyl-benzo[f]isoindole-4,9-dione Openeye Name: 3-(4-butylphenyl)-2-(1-naphthyl)-1-phenyl-benzo[f]isoindole-4,9-dione CAS Name: 3-(4-butylphenyl)-2-(1-naphthalenyl)-1-phenylbenzo[f]isoindole-4,9-dione IUPAC Name: 3-(4-butylphenyl)-2-naphthalen-1-yl-1-phenylbenzo[f]isoindole-4,9-dione Traditional Name: 3-(4-butylphenyl)-2-(1-naphthyl)-1-phenyl-benz[f]isoindole-4,9-quinone Formula: C38H29NO2 MolecularWeight: 531.64236

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C3C(=C(N2C4=CC=CC5=CC=CC=C54)C6=CC=CC=C6)C(=O)C7=CC=CC=C7C3=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C3C(=C(N2C4=CC=CC5=CC=CC=C54)C6=CC=CC=C6)C(=O)C7=CC=CC=C7C3=O

InChI

InChI=1S/C38H29NO2/c1-2-3-12-25-21-23-28(24-22-25)36-34-33(37(40)30-18-9-10-19-31(30)38(34)41)35(27-14-5-4-6-15-27)39(36)32-20-11-16-26-13-7-8-17-29(26)32/h4-11,13-24H,2-3,12H2,1H3