N-butan-2-yl-2-[(3-nitrophenyl)methylsulfonylamino]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

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