[2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate

Systemtic Name: [2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Openeye Name: [2-(1,2-dimethylpropylamino)-2-oxo-ethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate CAS Name: 2-[(4-ethoxyphenyl)sulfonylamino]benzoic acid [2-(3-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutan-2-ylamino)-2-oxoethyl] 2-[(4-ethoxyphenyl)sulfonylamino]benzoate Traditional Name: 2-(p-phenetylsulfonylamino)benzoic acid [2-(1,2-dimethylpropylamino)-2-keto-ethyl] ester Formula: C22H28N2O6S MolecularWeight: 448.53252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NC(C)C(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)OCC(=O)NC(C)C(C)C

InChI

InChI=1S/C22H28N2O6S/c1-5-29-17-10-12-18(13-11-17)31(27,28)24-20-9-7-6-8-19(20)22(26)30-14-21(25)23-16(4)15(2)3/h6-13,15-16,24H,5,14H2,1-4H3,(H,23,25)