diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1-(3-nitrophenyl)carbonylsulfanyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2,6-dimethyl-4-(3-nitrophenyl)-1-(3-nitrophenyl)carbonylsulfanyl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 2,6-dimethyl-1-(3-nitrobenzoyl)sulfanyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2,6-dimethyl-4-(3-nitrophenyl)-1-[[(3-nitrophenyl)-oxomethyl]thio]-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,6-dimethyl-1-(3-nitrobenzoyl)sulfanyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 2,6-dimethyl-1-[(3-nitrobenzoyl)thio]-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C26H25N3O9S MolecularWeight: 555.5564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)SC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)C)SC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C26H25N3O9S/c1-5-37-24(30)21-15(3)27(39-26(32)18-10-8-12-20(14-18)29(35)36)16(4)22(25(31)38-6-2)23(21)17-9-7-11-19(13-17)28(33)34/h7-14,23H,5-6H2,1-4H3