(3,3-dimethyl-2-oxidanylidene-butyl) 4-[(4-ethanoylphenyl)sulfonylamino]benzoate

Systemtic Name: (3,3-dimethyl-2-oxidanylidene-butyl) 4-[(4-ethanoylphenyl)sulfonylamino]benzoate Openeye Name: (3,3-dimethyl-2-oxo-butyl) 4-[(4-acetylphenyl)sulfonylamino]benzoate CAS Name: 4-[(4-acetylphenyl)sulfonylamino]benzoic acid (3,3-dimethyl-2-oxobutyl) ester IUPAC Name: (3,3-dimethyl-2-oxobutyl) 4-[(4-acetylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(4-acetylphenyl)sulfonylamino]benzoic acid (2-keto-3,3-dimethyl-butyl) ester Formula: C21H23NO6S MolecularWeight: 417.47542

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)OCC(=O)C(C)(C)C

InChI

InChI=1S/C21H23NO6S/c1-14(23)15-7-11-18(12-8-15)29(26,27)22-17-9-5-16(6-10-17)20(25)28-13-19(24)21(2,3)4/h5-12,22H,13H2,1-4H3