4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(3-chlorophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C13H10ClNO4 MolecularWeight: 279.6758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2C(=CNC=C2C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2C(=CNC=C2C(=O)O)C(=O)O

InChI

InChI=1S/C13H10ClNO4/c14-8-3-1-2-7(4-8)11-9(12(16)17)5-15-6-10(11)13(18)19/h1-6,11,15H,(H,16,17)(H,18,19)