N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-3-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-[2-(4-nitrophenyl)-2-oxidanyl-ethyl]-3-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-[2-hydroxy-2-(4-nitrophenyl)ethyl]-3-(propargylsulfamoyl)benzamide Formula: C18H17N3O6S MolecularWeight: 403.40908

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=CC(=C1)C(=O)NCC(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H17N3O6S/c1-2-10-20-28(26,27)16-5-3-4-14(11-16)18(23)19-12-17(22)13-6-8-15(9-7-13)21(24)25/h1,3-9,11,17,20,22H,10,12H2,(H,19,23)