N-cyclohexyl-2-[2-[methylsulfonyl-(3-nitrophenyl)amino]ethanoylamino]benzamide

Systemtic Name: N-cyclohexyl-2-[2-[methylsulfonyl-(3-nitrophenyl)amino]ethanoylamino]benzamide Openeye Name: N-cyclohexyl-2-[[2-(N-methylsulfonyl-3-nitro-anilino)acetyl]amino]benzamide CAS Name: N-cyclohexyl-2-[[2-(N-methylsulfonyl-3-nitroanilino)-1-oxoethyl]amino]benzamide IUPAC Name: N-cyclohexyl-2-[[2-(N-methylsulfonyl-3-nitroanilino)acetyl]amino]benzamide Traditional Name: N-cyclohexyl-2-[[2-(N-mesyl-3-nitro-anilino)acetyl]amino]benzamide Formula: C22H26N4O6S MolecularWeight: 474.53004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NC2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=CC=C1C(=O)NC2CCCCC2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O6S/c1-33(31,32)25(17-10-7-11-18(14-17)26(29)30)15-21(27)24-20-13-6-5-12-19(20)22(28)23-16-8-3-2-4-9-16/h5-7,10-14,16H,2-4,8-9,15H2,1H3,(H,23,28)(H,24,27)