N-butyl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide

Systemtic Name: N-butyl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide Openeye Name: N-butyl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide CAS Name: N-butyl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide IUPAC Name: N-butyl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide Traditional Name: N-butyl-2-[(3-nitrobenzyl)sulfonylamino]benzamide Formula: C18H21N3O5S MolecularWeight: 391.44144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC=CC=C1NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)C1=CC=CC=C1NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O5S/c1-2-3-11-19-18(22)16-9-4-5-10-17(16)20-27(25,26)13-14-7-6-8-15(12-14)21(23)24/h4-10,12,20H,2-3,11,13H2,1H3,(H,19,22)