methyl 2-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[(5-nitro-2-oxidanylidene-pyridin-1-yl)methyl]-4-phenyl-quinoline-3-carboxylate Openeye Name: methyl 2-[(5-nitro-2-oxo-1-pyridyl)methyl]-4-phenyl-quinoline-3-carboxylate CAS Name: 2-[(5-nitro-2-oxo-1-pyridinyl)methyl]-4-phenyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[(5-nitro-2-oxopyridin-1-yl)methyl]-4-phenylquinoline-3-carboxylate Traditional Name: 2-[(2-keto-5-nitro-1-pyridyl)methyl]-4-phenyl-quinoline-3-carboxylic acid methyl ester Formula: C23H17N3O5 MolecularWeight: 415.39818

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N=C1CN3C=C(C=CC3=O)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N=C1CN3C=C(C=CC3=O)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H17N3O5/c1-31-23(28)22-19(14-25-13-16(26(29)30)11-12-20(25)27)24-18-10-6-5-9-17(18)21(22)15-7-3-2-4-8-15/h2-13H,14H2,1H3