2-(furan-3-yl)-5-methoxycarbonyl-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 2-(furan-3-yl)-5-methoxycarbonyl-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Openeye Name: 2-(3-furyl)-5-methoxycarbonyl-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 2-(3-furanyl)-5-methoxycarbonyl-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 2-(furan-3-yl)-5-methoxycarbonyl-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-2-(3-furyl)-6-methyl-1-(4-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C3=COC=C3)C(=O)O)C(=O)OC

Isomeric SMILES

CC1=C(CC(=C(N1C2=CC=C(C=C2)[N+](=O)[O-])C3=COC=C3)C(=O)O)C(=O)OC

InChI

InChI=1S/C19H16N2O7/c1-11-15(19(24)27-2)9-16(18(22)23)17(12-7-8-28-10-12)20(11)13-3-5-14(6-4-13)21(25)26/h3-8,10H,9H2,1-2H3,(H,22,23)