N-[4-[(3-methylphenyl)carbonylamino]phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-[(3-methylphenyl)carbonylamino]phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[4-[(3-methylbenzoyl)amino]phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[4-[[(3-methylphenyl)-oxomethyl]amino]phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[4-[(3-methylbenzoyl)amino]phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: 4-(4-methylpiperidino)-N-[4-(m-toluoylamino)phenyl]-3-nitro-benzamide Formula: C27H28N4O4 MolecularWeight: 472.53562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)NC(=O)C4=CC(=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C27H28N4O4/c1-18-12-14-30(15-13-18)24-11-6-21(17-25(24)31(34)35)27(33)29-23-9-7-22(8-10-23)28-26(32)20-5-3-4-19(2)16-20/h3-11,16-18H,12-15H2,1-2H3,(H,28,32)(H,29,33)