bis(pyridin-3-ylmethyl) 2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: bis(pyridin-3-ylmethyl) 2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: bis(3-pyridylmethyl) 2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(1-methyl-5-nitro-2-imidazolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(3-pyridinylmethyl) ester IUPAC Name: bis(pyridin-3-ylmethyl) 2,6-dimethyl-4-(1-methyl-5-nitroimidazol-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(1-methyl-5-nitro-imidazol-2-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid bis(3-pyridylmethyl) ester Formula: C25H24N6O6 MolecularWeight: 504.49466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CN=CC=C2)C3=NC=C(N3C)[N+](=O)[O-])C(=O)OCC4=CN=CC=C4

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OCC2=CN=CC=C2)C3=NC=C(N3C)[N+](=O)[O-])C(=O)OCC4=CN=CC=C4

InChI

InChI=1S/C25H24N6O6/c1-15-20(24(32)36-13-17-6-4-8-26-10-17)22(23-28-12-19(30(23)3)31(34)35)21(16(2)29-15)25(33)37-14-18-7-5-9-27-11-18/h4-12,22,29H,13-14H2,1-3H3