2,6-dimethyl-4-(3-nitrophenyl)-5-quinolin-4-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-quinolin-4-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(4-quinolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(4-quinolinyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-quinolin-4-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2,6-dimethyl-4-(3-nitrophenyl)-5-(4-quinolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C23H19N3O4 MolecularWeight: 401.41466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=NC4=CC=CC=C34

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=NC4=CC=CC=C34

InChI

InChI=1S/C23H19N3O4/c1-13-20(18-10-11-24-19-9-4-3-8-17(18)19)22(21(23(27)28)14(2)25-13)15-6-5-7-16(12-15)26(29)30/h3-12,22,25H,1-2H3,(H,27,28)