O3-ethyl O5-phenethyl 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-phenethyl 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-phenethyl 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-methyl-5-nitro-4-imidazolyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-phenethyl ester IUPAC Name: 3-O-ethyl 5-O-phenethyl 2,6-dimethyl-4-(3-methyl-5-nitroimidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-4-(3-methyl-5-nitro-imidazol-4-yl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-phenethyl ester Formula: C23H26N4O6 MolecularWeight: 454.47574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCC3=CC=CC=C3)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=C(N=CN2C)[N+](=O)[O-])C(=O)OCCC3=CC=CC=C3)C)C

InChI

InChI=1S/C23H26N4O6/c1-5-32-22(28)17-14(2)25-15(3)18(19(17)20-21(27(30)31)24-13-26(20)4)23(29)33-12-11-16-9-7-6-8-10-16/h6-10,13,19,25H,5,11-12H2,1-4H3