4-(2-cyanopyridin-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(2-cyanopyridin-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(2-cyano-4-pyridyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(2-cyano-4-pyridinyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(2-cyanopyridin-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(2-cyano-4-pyridyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C15H13N3O4 MolecularWeight: 299.28142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=NC=C2)C#N)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=NC=C2)C#N)C(=O)O

InChI

InChI=1S/C15H13N3O4/c1-7-11(14(19)20)13(12(15(21)22)8(2)18-7)9-3-4-17-10(5-9)6-16/h3-5,13,18H,1-2H3,(H,19,20)(H,21,22)