N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3,5-dinitro-benzamide

Systemtic Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3,5-dinitro-benzamide Openeye Name: 3,5-dinitro-N-[4-(p-tolylsulfonylamino)phenyl]benzamide CAS Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3,5-dinitrobenzamide IUPAC Name: N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-3,5-dinitrobenzamide Traditional Name: 3,5-dinitro-N-[4-(tosylamino)phenyl]benzamide Formula: C20H16N4O7S MolecularWeight: 456.42864

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N4O7S/c1-13-2-8-19(9-3-13)32(30,31)22-16-6-4-15(5-7-16)21-20(25)14-10-17(23(26)27)12-18(11-14)24(28)29/h2-12,22H,1H3,(H,21,25)