2-acetamido-2-cyano-3-[3-(phenylcarbonyl)phenyl]propanoic acid

Systemtic Name: 2-acetamido-2-cyano-3-[3-(phenylcarbonyl)phenyl]propanoic acid Openeye Name: 2-acetamido-3-(3-benzoylphenyl)-2-cyano-propanoic acid CAS Name: 2-acetamido-3-(3-benzoylphenyl)-2-cyanopropanoic acid IUPAC Name: 2-acetamido-3-(3-benzoylphenyl)-2-cyanopropanoic acid Traditional Name: 2-acetamido-3-(3-benzoylphenyl)-2-cyano-propionic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=CC(=C1)C(=O)C2=CC=CC=C2)(C#N)C(=O)O

Isomeric SMILES

CC(=O)NC(CC1=CC=CC(=C1)C(=O)C2=CC=CC=C2)(C#N)C(=O)O

InChI

InChI=1S/C19H16N2O4/c1-13(22)21-19(12-20,18(24)25)11-14-6-5-9-16(10-14)17(23)15-7-3-2-4-8-15/h2-10H,11H2,1H3,(H,21,22)(H,24,25)