[2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [2-(2-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: [2-(1,1-dimethylpropylamino)-2-oxo-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]benzoic acid [2-(2-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylbutan-2-ylamino)-2-oxoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-(p-phenetylsulfonylamino)benzoic acid [2-(tert-amylamino)-2-keto-ethyl] ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCC(C)(C)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C22H28N2O6S/c1-5-22(3,4)23-20(25)15-30-21(26)18-9-7-8-10-19(18)24-31(27,28)17-13-11-16(12-14-17)29-6-2/h7-14,24H,5-6,15H2,1-4H3,(H,23,25)