[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (Z)-2-acetamido-3-phenyl-2-propenoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] (Z)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (Z)-2-acetamido-3-phenyl-acrylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)/C(=C/C1=CC=CC=C1)/NC(=O)C)/N

InChI

InChI=1S/C17H17N3O4/c1-11(19)14(9-18)16(22)10-24-17(23)15(20-12(2)21)8-13-6-4-3-5-7-13/h3-8H,10,19H2,1-2H3,(H,20,21)/b14-11+,15-8-