6-azanyl-4-(3-cyanophenyl)-5-ethoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-azanyl-4-(3-cyanophenyl)-5-ethoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-amino-4-(3-cyanophenyl)-5-ethoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-amino-4-(3-cyanophenyl)-5-ethoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-amino-4-(3-cyanophenyl)-5-ethoxycarbonyl-2-methyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 6-amino-5-carbethoxy-4-(3-cyanophenyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid Formula: C17H17N3O4 MolecularWeight: 327.33458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O4/c1-3-24-17(23)14-13(11-6-4-5-10(7-11)8-18)12(16(21)22)9(2)20-15(14)19/h4-7,13,20H,3,19H2,1-2H3,(H,21,22)