5-methoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 5-methoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-methoxycarbonyl-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-methoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-methoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C17H19NO4 MolecularWeight: 301.33706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)OC)C)C)C(=O)O

InChI

InChI=1S/C17H19NO4/c1-9-5-7-12(8-6-9)15-13(16(19)20)10(2)18-11(3)14(15)17(21)22-4/h5-8,15,18H,1-4H3,(H,19,20)