N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-nitro-benzamide

Systemtic Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-nitro-benzamide Openeye Name: 2-nitro-N-(p-tolyl)-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-nitrobenzamide IUPAC Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-2-nitrobenzamide Traditional Name: 2-nitro-N-(p-tolyl)-N-tosyl-benzamide Formula: C21H18N2O5S MolecularWeight: 410.44302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C(=O)C2=CC=CC=C2[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H18N2O5S/c1-15-7-11-17(12-8-15)22(29(27,28)18-13-9-16(2)10-14-18)21(24)19-5-3-4-6-20(19)23(25)26/h3-14H,1-2H3