[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(2-nitrophenyl)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(2-nitrophenyl)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(2-nitrophenyl)acetate CAS Name: 2-(2-nitrophenyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(2-nitrophenyl)acetate Traditional Name: 2-(2-nitrophenyl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CC1=CC=CC=C1[N+](=O)[O-])N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CC1=CC=CC=C1[N+](=O)[O-])/N

InChI

InChI=1S/C14H13N3O5/c1-9(16)11(7-15)13(18)8-22-14(19)6-10-4-2-3-5-12(10)17(20)21/h2-5H,6,8,16H2,1H3/b11-9+