(3,4-dimethylphenyl) 3-(cyclopropylsulfamoyl)benzenesulfonate

Systemtic Name: (3,4-dimethylphenyl) 3-(cyclopropylsulfamoyl)benzenesulfonate Openeye Name: (3,4-dimethylphenyl) 3-(cyclopropylsulfamoyl)benzenesulfonate CAS Name: 3-(cyclopropylsulfamoyl)benzenesulfonic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 3-(cyclopropylsulfamoyl)benzenesulfonate Traditional Name: 3-(cyclopropylsulfamoyl)benzenesulfonic acid (3,4-dimethylphenyl) ester Formula: C17H19NO5S2 MolecularWeight: 381.46646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)OS(=O)(=O)C2=CC=CC(=C2)S(=O)(=O)NC3CC3)C

InChI

InChI=1S/C17H19NO5S2/c1-12-6-9-15(10-13(12)2)23-25(21,22)17-5-3-4-16(11-17)24(19,20)18-14-7-8-14/h3-6,9-11,14,18H,7-8H2,1-2H3