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

Systemtic Name: 2,6-diethyl-4-(3-pyridin-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 2,6-diethyl-4-[3-(3-pyridyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 2,6-diethyl-4-[3-(3-pyridinyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 2,6-diethyl-4-(3-pyridin-3-ylphenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 2,6-diethyl-4-[3-(3-pyridyl)phenyl]-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C(=C(N1)CC)C(=O)O)C2=CC=CC(=C2)C3=CN=CC=C3)C(=O)O

Isomeric SMILES

CCC1=C(C(C(=C(N1)CC)C(=O)O)C2=CC=CC(=C2)C3=CN=CC=C3)C(=O)O

InChI

InChI=1S/C22H22N2O4/c1-3-16-19(21(25)26)18(20(22(27)28)17(4-2)24-16)14-8-5-7-13(11-14)15-9-6-10-23-12-15/h5-12,18,24H,3-4H2,1-2H3,(H,25,26)(H,27,28)