3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-dione

Systemtic Name: 3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-dione Openeye Name: 3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-dione CAS Name: 3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-dione IUPAC Name: 3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-dione Traditional Name: 3-(1,4-diphenylbutyl)-6-methoxy-2H-benzo[g]phthalazine-1,4-quinone Formula: C29H26N2O3 MolecularWeight: 450.52834

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=CC3=C(C=C21)C(=O)N(NC3=O)C(CCCC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC2=CC3=C(C=C21)C(=O)N(NC3=O)C(CCCC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H26N2O3/c1-34-27-17-9-15-22-18-24-25(19-23(22)27)29(33)31(30-28(24)32)26(21-13-6-3-7-14-21)16-8-12-20-10-4-2-5-11-20/h2-7,9-11,13-15,17-19,26H,8,12,16H2,1H3,(H,30,32)