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

Systemtic Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 5-ethoxycarbonyl-2,6-dimethyl-4-(4-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbethoxy-2,6-dimethyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C(=O)O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C(=O)O)C)C

InChI

InChI=1S/C18H21NO4/c1-5-23-18(22)15-12(4)19-11(3)14(17(20)21)16(15)13-8-6-10(2)7-9-13/h6-9,16,19H,5H2,1-4H3,(H,20,21)