N-(2-methoxy-5-nitro-phenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide Openeye Name: 2-[benzyl(p-tolylsulfonyl)amino]-N-(2-methoxy-5-nitro-phenyl)benzamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[(4-methylphenyl)sulfonyl-(phenylmethyl)amino]benzamide IUPAC Name: 2-[benzyl-(4-methylphenyl)sulfonylamino]-N-(2-methoxy-5-nitrophenyl)benzamide Traditional Name: 2-[benzyl(tosyl)amino]-N-(2-methoxy-5-nitro-phenyl)benzamide Formula: C28H25N3O6S MolecularWeight: 531.5796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=CC=C2)C3=CC=CC=C3C(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C28H25N3O6S/c1-20-12-15-23(16-13-20)38(35,36)30(19-21-8-4-3-5-9-21)26-11-7-6-10-24(26)28(32)29-25-18-22(31(33)34)14-17-27(25)37-2/h3-18H,19H2,1-2H3,(H,29,32)