N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide

Systemtic Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-3-nitro-benzamide Openeye Name: 3-nitro-N-(p-tolyl)-N-(p-tolylsulfonyl)benzamide CAS Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide IUPAC Name: N-(4-methylphenyl)-N-(4-methylphenyl)sulfonyl-3-nitrobenzamide Traditional Name: 3-nitro-N-(p-tolyl)-N-tosyl-benzamide Formula: C21H18N2O5S MolecularWeight: 410.44302

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