3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione

Systemtic Name: 3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione Openeye Name: 3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione CAS Name: 3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione IUPAC Name: 3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-dione Traditional Name: 3,5,8-triphenyl-4a,5,8,8a-tetrahydro-2H-phthalazine-1,4-quinone Formula: C26H22N2O2 MolecularWeight: 394.46508

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C=CC(C3C2C(=O)NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2C=CC(C3C2C(=O)NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H22N2O2/c29-25-23-21(18-10-4-1-5-11-18)16-17-22(19-12-6-2-7-13-19)24(23)26(30)28(27-25)20-14-8-3-9-15-20/h1-17,21-24H,(H,27,29)