N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(2-methyl-5-nitro-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide

Systemtic Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(2-methyl-5-nitro-phenyl)carbonylpiperidin-4-yl]pyridine-3-carboxamide Openeye Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(2-methyl-5-nitro-benzoyl)-4-piperidyl]pyridine-3-carboxamide CAS Name: N-[4-(1-imidazolyl)phenyl]-6-methyl-2-[1-[(2-methyl-5-nitrophenyl)-oxomethyl]-4-piperidinyl]-3-pyridinecarboxamide IUPAC Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(2-methyl-5-nitrobenzoyl)piperidin-4-yl]pyridine-3-carboxamide Traditional Name: N-(4-imidazol-1-ylphenyl)-6-methyl-2-[1-(2-methyl-5-nitro-benzoyl)-4-piperidyl]nicotinamide Formula: C29H28N6O4 MolecularWeight: 524.57042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NC4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCC(CC2)C3=C(C=CC(=N3)C)C(=O)NC4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C29H28N6O4/c1-19-3-7-24(35(38)39)17-26(19)29(37)33-14-11-21(12-15-33)27-25(10-4-20(2)31-27)28(36)32-22-5-8-23(9-6-22)34-16-13-30-18-34/h3-10,13,16-18,21H,11-12,14-15H2,1-2H3,(H,32,36)