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

Systemtic Name: 6-[4-(4-chlorophenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-3-methyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(4-chlorophenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-3-methyl-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(4-chlorophenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-3-methyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(4-chlorophenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-3-methylcyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(4-chlorophenyl)-1,3-dihydro-1,5-benzodiazepin-2-ylidene]-3-methyl-cyclohexa-2,4-dien-1-one Formula: C22H17ClN2O MolecularWeight: 360.83618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C2CC(=NC3=CC=CC=C3N2)C4=CC=C(C=C4)Cl)C=C1

Isomeric SMILES

CC1=CC(=O)C(=C2CC(=NC3=CC=CC=C3N2)C4=CC=C(C=C4)Cl)C=C1

InChI

InChI=1S/C22H17ClN2O/c1-14-6-11-17(22(26)12-14)21-13-20(15-7-9-16(23)10-8-15)24-18-4-2-3-5-19(18)25-21/h2-12,25H,13H2,1H3