5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-(2-oxidanylideneethyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-(2-oxidanylideneethyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-(2-oxoethyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-(2-oxoethyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-methoxycarbonyl-2-methyl-4-(3-nitrophenyl)-6-(2-oxoethyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-6-(2-ketoethyl)-2-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C17H16N2O7 MolecularWeight: 360.31814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)CC=O)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)CC=O)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C17H16N2O7/c1-9-13(16(21)22)14(10-4-3-5-11(8-10)19(24)25)15(17(23)26-2)12(18-9)6-7-20/h3-5,7-8,14,18H,6H2,1-2H3,(H,21,22)