(2E)-1-(4-methyl-2-oxidanyl-phenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone

Systemtic Name: (2E)-1-(4-methyl-2-oxidanyl-phenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone Openeye Name: (2E)-1-(2-hydroxy-4-methyl-phenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone CAS Name: (2E)-1-(2-hydroxy-4-methylphenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone IUPAC Name: (2E)-1-(2-hydroxy-4-methylphenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone Traditional Name: (2E)-1-(2-hydroxy-4-methyl-phenyl)-2-(7-phenyl-1,4-diazepan-5-ylidene)ethanone Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)C=C2CC(NCCN2)C3=CC=CC=C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)/C=C/2\CC(NCCN2)C3=CC=CC=C3)O

InChI

InChI=1S/C20H22N2O2/c1-14-7-8-17(19(23)11-14)20(24)13-16-12-18(22-10-9-21-16)15-5-3-2-4-6-15/h2-8,11,13,18,21-23H,9-10,12H2,1H3/b16-13+