N-[3-[(4-methylphenyl)sulfonylamino]propyl]-4-nitro-benzamide

Systemtic Name: N-[3-[(4-methylphenyl)sulfonylamino]propyl]-4-nitro-benzamide Openeye Name: 4-nitro-N-[3-(p-tolylsulfonylamino)propyl]benzamide CAS Name: N-[3-[(4-methylphenyl)sulfonylamino]propyl]-4-nitrobenzamide IUPAC Name: N-[3-[(4-methylphenyl)sulfonylamino]propyl]-4-nitrobenzamide Traditional Name: 4-nitro-N-[3-(tosylamino)propyl]benzamide Formula: C17H19N3O5S MolecularWeight: 377.41486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19N3O5S/c1-13-3-9-16(10-4-13)26(24,25)19-12-2-11-18-17(21)14-5-7-15(8-6-14)20(22)23/h3-10,19H,2,11-12H2,1H3,(H,18,21)