2,6-dimethyl-4-(3-pyridin-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 2,6-dimethyl-4-(3-pyridin-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-dimethyl-4-[3-(3-pyridyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-dimethyl-4-[3-(3-pyridinyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-pyridin-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2,6-dimethyl-4-[3-(3-pyridyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C20H18N2O4 MolecularWeight: 350.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC(=C2)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC=CC(=C2)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C20H18N2O4/c1-11-16(19(23)24)18(17(20(25)26)12(2)22-11)14-6-3-5-13(9-14)15-7-4-8-21-10-15/h3-10,18,22H,1-2H3,(H,23,24)(H,25,26)