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

Systemtic Name: 4-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]-N-propyl-benzamide Openeye Name: 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-N-propyl-benzamide CAS Name: 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-N-propylbenzamide IUPAC Name: 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-N-propylbenzamide Traditional Name: 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-N-propyl-benzamide Formula: C16H17N3O6S MolecularWeight: 379.38768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O6S/c1-2-9-17-16(21)11-3-5-12(6-4-11)18-26(24,25)13-7-8-15(20)14(10-13)19(22)23/h3-8,10,18,20H,2,9H2,1H3,(H,17,21)