butyl 4-(3-sulfamoylphenyl)sulfonyloxybenzoate

Systemtic Name: butyl 4-(3-sulfamoylphenyl)sulfonyloxybenzoate Openeye Name: butyl 4-(3-sulfamoylphenyl)sulfonyloxybenzoate CAS Name: 4-(3-sulfamoylphenyl)sulfonyloxybenzoic acid butyl ester IUPAC Name: butyl 4-(3-sulfamoylphenyl)sulfonyloxybenzoate Traditional Name: 4-(3-sulfamoylphenyl)sulfonyloxybenzoic acid butyl ester Formula: C17H19NO7S2 MolecularWeight: 413.46526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C17H19NO7S2/c1-2-3-11-24-17(19)13-7-9-14(10-8-13)25-27(22,23)16-6-4-5-15(12-16)26(18,20)21/h4-10,12H,2-3,11H2,1H3,(H2,18,20,21)