N-[(2-methylphenyl)-phenyl-methyl]-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide

Systemtic Name: N-[(2-methylphenyl)-phenyl-methyl]-2-[methylsulfonyl-(3-nitrophenyl)amino]ethanamide Openeye Name: 2-(N-methylsulfonyl-3-nitro-anilino)-N-[o-tolyl(phenyl)methyl]acetamide CAS Name: N-[(2-methylphenyl)-phenylmethyl]-2-(N-methylsulfonyl-3-nitroanilino)acetamide IUPAC Name: N-[(2-methylphenyl)-phenylmethyl]-2-(N-methylsulfonyl-3-nitroanilino)acetamide Traditional Name: 2-(N-mesyl-3-nitro-anilino)-N-[o-tolyl(phenyl)methyl]acetamide Formula: C23H23N3O5S MolecularWeight: 453.51082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)NC(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)NC(=O)CN(C3=CC(=CC=C3)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C23H23N3O5S/c1-17-9-6-7-14-21(17)23(18-10-4-3-5-11-18)24-22(27)16-25(32(2,30)31)19-12-8-13-20(15-19)26(28)29/h3-15,23H,16H2,1-2H3,(H,24,27)