4-isoquinolin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-isoquinolin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(1-isoquinolyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(1-isoquinolinyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-isoquinolin-1-yl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(1-isoquinolyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C18H16N2O4 MolecularWeight: 324.33064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=NC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=NC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C18H16N2O4/c1-9-13(17(21)22)15(14(18(23)24)10(2)20-9)16-12-6-4-3-5-11(12)7-8-19-16/h3-8,15,20H,1-2H3,(H,21,22)(H,23,24)