4-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]-2H-phthalazin-1-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]-2H-phthalazin-1-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-[4-(2-methylbenzoyl)piperazin-1-yl]-2H-phthalazin-1-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]-2H-phthalazin-1-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-[4-(2-methylbenzoyl)piperazin-1-yl]-2H-phthalazin-1-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[4-(4-o-toluoylpiperazino)-2H-phthalazin-1-ylidene]cyclohexa-2,5-dien-1-one Formula: C26H24N4O2 MolecularWeight: 424.49436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NNC(=C4C=CC(=O)C=C4)C5=CC=CC=C53

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NNC(=C4C=CC(=O)C=C4)C5=CC=CC=C53

InChI

InChI=1S/C26H24N4O2/c1-18-6-2-3-7-21(18)26(32)30-16-14-29(15-17-30)25-23-9-5-4-8-22(23)24(27-28-25)19-10-12-20(31)13-11-19/h2-13,27H,14-17H2,1H3