ethyl 5-nitro-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-nitro-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]pyridine-3-carboxylate Openeye Name: ethyl 5-nitro-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]pyridine-3-carboxylate CAS Name: 5-nitro-2-[(E)-2-(1-phenyl-4-pyrazolyl)ethenyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-nitro-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]pyridine-3-carboxylate Traditional Name: 5-nitro-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]nicotinic acid ethyl ester Formula: C19H16N4O4 MolecularWeight: 364.35474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN=C1C=CC2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CN=C1/C=C/C2=CN(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O4/c1-2-27-19(24)17-10-16(23(25)26)12-20-18(17)9-8-14-11-21-22(13-14)15-6-4-3-5-7-15/h3-13H,2H2,1H3/b9-8+