(6E)-6-[4-(4-methylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(4-methylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(p-tolyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(4-methylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(4-methylphenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(p-tolyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C22H18N2O MolecularWeight: 326.39112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3NC(=C4C=CC=CC4=O)C2

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=CC=CC=C3N/C(=C/4\C=CC=CC4=O)/C2

InChI

InChI=1S/C22H18N2O/c1-15-10-12-16(13-11-15)20-14-21(17-6-2-5-9-22(17)25)24-19-8-4-3-7-18(19)23-20/h2-13,24H,14H2,1H3/b21-17+