N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-2-[(4-methylphenyl)sulfonylamino]-5-nitro-benzamide

Systemtic Name: N-[4-bromanyl-2-(phenylcarbonyl)phenyl]-2-[(4-methylphenyl)sulfonylamino]-5-nitro-benzamide Openeye Name: N-(2-benzoyl-4-bromo-phenyl)-5-nitro-2-(p-tolylsulfonylamino)benzamide CAS Name: N-(2-benzoyl-4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]-5-nitrobenzamide IUPAC Name: N-(2-benzoyl-4-bromophenyl)-2-[(4-methylphenyl)sulfonylamino]-5-nitrobenzamide Traditional Name: N-(2-benzoyl-4-bromo-phenyl)-5-nitro-2-(tosylamino)benzamide Formula: C27H20BrN3O6S MolecularWeight: 594.4332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=C(C=C(C=C3)Br)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H20BrN3O6S/c1-17-7-11-21(12-8-17)38(36,37)30-25-14-10-20(31(34)35)16-23(25)27(33)29-24-13-9-19(28)15-22(24)26(32)18-5-3-2-4-6-18/h2-16,30H,1H3,(H,29,33)