4-(2-chlorophenyl)-2-methyl-6-(2-oxidanylideneethoxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-chlorophenyl)-2-methyl-6-(2-oxidanylideneethoxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-chlorophenyl)-2-methyl-6-(2-oxoethoxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(2-chlorophenyl)-2-methyl-6-(2-oxoethoxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-chlorophenyl)-2-methyl-6-(2-oxoethoxymethyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-chlorophenyl)-2-(2-ketoethoxymethyl)-6-methyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H16ClNO6 MolecularWeight: 365.76504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)COCC=O)C(=O)O)C2=CC=CC=C2Cl)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)COCC=O)C(=O)O)C2=CC=CC=C2Cl)C(=O)O

InChI

InChI=1S/C17H16ClNO6/c1-9-13(16(21)22)14(10-4-2-3-5-11(10)18)15(17(23)24)12(19-9)8-25-7-6-20/h2-6,14,19H,7-8H2,1H3,(H,21,22)(H,23,24)