[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (E)-3-quinoxalin-2-ylprop-2-enoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] (E)-3-quinoxalin-2-ylprop-2-enoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] (E)-3-quinoxalin-2-ylprop-2-enoate CAS Name: (E)-3-(2-quinoxalinyl)-2-propenoic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] (E)-3-quinoxalin-2-ylprop-2-enoate Traditional Name: (E)-3-quinoxalin-2-ylacrylic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C17H14N4O3 MolecularWeight: 322.31806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)C=CC1=NC2=CC=CC=C2N=C1)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)/C=C/C1=NC2=CC=CC=C2N=C1)/N

InChI

InChI=1S/C17H14N4O3/c1-11(19)13(8-18)16(22)10-24-17(23)7-6-12-9-20-14-4-2-3-5-15(14)21-12/h2-7,9H,10,19H2,1H3/b7-6+,13-11+