(6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(2,4-dimethyl-1H-1,5-benzodiazepin-3-yl)methylene]cyclohexa-2,4-dien-1-one Formula: C18H16N2O MolecularWeight: 276.33244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C2N1)C)C=C3C=CC=CC3=O

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C2N1)C)/C=C/3\C=CC=CC3=O

InChI

InChI=1S/C18H16N2O/c1-12-15(11-14-7-3-6-10-18(14)21)13(2)20-17-9-5-4-8-16(17)19-12/h3-11,19H,1-2H3/b14-11+