ethyl (2E)-2-(3-nitro-1H-pyridin-4-ylidene)-3-oxidanylidene-3-phenyl-propanoate

Systemtic Name: ethyl (2E)-2-(3-nitro-1H-pyridin-4-ylidene)-3-oxidanylidene-3-phenyl-propanoate Openeye Name: ethyl (2E)-2-(3-nitro-1H-pyridin-4-ylidene)-3-oxo-3-phenyl-propanoate CAS Name: (2E)-2-(3-nitro-1H-pyridin-4-ylidene)-3-oxo-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-(3-nitro-1H-pyridin-4-ylidene)-3-oxo-3-phenylpropanoate Traditional Name: (2E)-3-keto-2-(3-nitro-1H-pyridin-4-ylidene)-3-phenyl-propionic acid ethyl ester Formula: C16H14N2O5 MolecularWeight: 314.29276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1C=CNC=C1[N+](=O)[O-])C(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C(=C/1\C=CNC=C1[N+](=O)[O-])/C(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H14N2O5/c1-2-23-16(20)14(15(19)11-6-4-3-5-7-11)12-8-9-17-10-13(12)18(21)22/h3-10,17H,2H2,1H3/b14-12+