methyl 5-[(E)-2-[3-[(3-nitropyridin-2-yl)amino]phenyl]ethenyl]pyridine-3-carboxylate

Systemtic Name: methyl 5-[(E)-2-[3-[(3-nitropyridin-2-yl)amino]phenyl]ethenyl]pyridine-3-carboxylate Openeye Name: methyl 5-[(E)-2-[3-[(3-nitro-2-pyridyl)amino]phenyl]vinyl]pyridine-3-carboxylate CAS Name: 5-[(E)-2-[3-[(3-nitro-2-pyridinyl)amino]phenyl]ethenyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-2-[3-[(3-nitropyridin-2-yl)amino]phenyl]ethenyl]pyridine-3-carboxylate Traditional Name: 5-[(E)-2-[3-[(3-nitro-2-pyridyl)amino]phenyl]vinyl]nicotinic acid methyl ester Formula: C20H16N4O4 MolecularWeight: 376.36544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=CC(=C1)C=CC2=CC(=CC=C2)NC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CN=CC(=C1)/C=C/C2=CC(=CC=C2)NC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O4/c1-28-20(25)16-10-15(12-21-13-16)8-7-14-4-2-5-17(11-14)23-19-18(24(26)27)6-3-9-22-19/h2-13H,1H3,(H,22,23)/b8-7+