methyl 4-(1-cyano-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)benzoate

Systemtic Name: methyl 4-(1-cyano-2-ethoxy-2-oxidanylidene-1-phenyl-ethyl)benzoate Openeye Name: methyl 4-(1-cyano-2-ethoxy-2-oxo-1-phenyl-ethyl)benzoate CAS Name: 4-(1-cyano-2-ethoxy-2-oxo-1-phenylethyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-cyano-2-ethoxy-2-oxo-1-phenylethyl)benzoate Traditional Name: 4-(1-cyano-2-ethoxy-2-keto-1-phenyl-ethyl)benzoic acid methyl ester Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)(C1=CC=CC=C1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCOC(=O)C(C#N)(C1=CC=CC=C1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C19H17NO4/c1-3-24-18(22)19(13-20,15-7-5-4-6-8-15)16-11-9-14(10-12-16)17(21)23-2/h4-12H,3H2,1-2H3