methyl (2Z)-2-(benzamidomethylidene)-3-oxidanylidene-butanoate

Systemtic Name: methyl (2Z)-2-(benzamidomethylidene)-3-oxidanylidene-butanoate Openeye Name: methyl (2Z)-2-(benzamidomethylene)-3-oxo-butanoate CAS Name: (2Z)-2-(benzamidomethylidene)-3-oxobutanoic acid methyl ester IUPAC Name: methyl (2Z)-2-(benzamidomethylidene)-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-benzamido-acrylic acid methyl ester Formula: C13H13NO4 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CNC(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(=O)/C(=C/NC(=O)C1=CC=CC=C1)/C(=O)OC

InChI

InChI=1S/C13H13NO4/c1-9(15)11(13(17)18-2)8-14-12(16)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,14,16)/b11-8-