dimethyl 2,6-dimethyl-4-(3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl 2,6-dimethyl-4-(3-oxidanidyl-2,1,3-benzoxadiazol-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl 2,6-dimethyl-4-(3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2,6-dimethyl-4-(3-oxido-2,1,3-benzoxadiazol-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-oxidobenzofurazan-3-ium-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C17H17N3O6 MolecularWeight: 359.33338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC3=NO[N+](=C32)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC=CC3=NO[N+](=C32)[O-])C(=O)OC

InChI

InChI=1S/C17H17N3O6/c1-8-12(16(21)24-3)14(13(9(2)18-8)17(22)25-4)10-6-5-7-11-15(10)20(23)26-19-11/h5-7,14,18H,1-4H3