(1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-oxidanylidene-5-phenyl-penta-1,4-dien-1-olate

Systemtic Name: (1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-oxidanylidene-5-phenyl-penta-1,4-dien-1-olate Openeye Name: (1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-oxo-5-phenyl-penta-1,4-dien-1-olate CAS Name: (1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-oxo-5-phenyl-1-penta-1,4-dienolate IUPAC Name: (1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-oxo-5-phenylpenta-1,4-dien-1-olate Traditional Name: (1E,4Z)-4-benzamido-2-cyano-1-ethoxy-3-keto-5-phenyl-penta-1,4-dien-1-olate Formula: C21H17N2O4- MolecularWeight: 361.37068

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C#N)C(=O)C(=CC1=CC=CC=C1)NC(=O)C2=CC=CC=C2)[O-]

Isomeric SMILES

CCO/C(=C(\C#N)/C(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C2=CC=CC=C2)/[O-]

InChI

InChI=1S/C21H18N2O4/c1-2-27-21(26)17(14-22)19(24)18(13-15-9-5-3-6-10-15)23-20(25)16-11-7-4-8-12-16/h3-13,26H,2H2,1H3,(H,23,25)/p-1/b18-13-,21-17+