(3,3-dimethyl-2-oxidanylidene-butyl) 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C23H29NO5S MolecularWeight: 431.54506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C23H29NO5S/c1-5-6-8-17-11-13-19(14-12-17)24-30(27,28)20-10-7-9-18(15-20)22(26)29-16-21(25)23(2,3)4/h7,9-15,24H,5-6,8,16H2,1-4H3