3-[(2-prop-2-enylsulfanylphenyl)sulfamoyl]benzoate

Systemtic Name: 3-[(2-prop-2-enylsulfanylphenyl)sulfamoyl]benzoate Openeye Name: 3-[(2-allylsulfanylphenyl)sulfamoyl]benzoate CAS Name: 3-[[2-(prop-2-enylthio)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[(2-prop-2-enylsulfanylphenyl)sulfamoyl]benzoate Traditional Name: 3-[[2-(allylthio)phenyl]sulfamoyl]benzoate Formula: C16H14NO4S2- MolecularWeight: 348.41666

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-]

Isomeric SMILES

C=CCSC1=CC=CC=C1NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C16H15NO4S2/c1-2-10-22-15-9-4-3-8-14(15)17-23(20,21)13-7-5-6-12(11-13)16(18)19/h2-9,11,17H,1,10H2,(H,18,19)/p-1