4-(cyclopropylsulfamoyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]benzamide

Systemtic Name: 4-(cyclopropylsulfamoyl)-N-[(5-nitro-2-oxidanyl-phenyl)methyl]benzamide Openeye Name: 4-(cyclopropylsulfamoyl)-N-[(2-hydroxy-5-nitro-phenyl)methyl]benzamide CAS Name: 4-(cyclopropylsulfamoyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]benzamide IUPAC Name: 4-(cyclopropylsulfamoyl)-N-[(2-hydroxy-5-nitrophenyl)methyl]benzamide Traditional Name: 4-(cyclopropylsulfamoyl)-N-(2-hydroxy-5-nitro-benzyl)benzamide Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C(C=CC(=C3)[N+](=O)[O-])O

InChI

InChI=1S/C17H17N3O6S/c21-16-8-5-14(20(23)24)9-12(16)10-18-17(22)11-1-6-15(7-2-11)27(25,26)19-13-3-4-13/h1-2,5-9,13,19,21H,3-4,10H2,(H,18,22)