[2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: [2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: [2-(1,2-dimethylpropylamino)-2-oxo-ethyl] 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 3-[(3-chlorophenyl)-methylsulfamoyl]benzoic acid [2-(3-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutan-2-ylamino)-2-oxoethyl] 3-[(3-chlorophenyl)-methylsulfamoyl]benzoate Traditional Name: 3-[(3-chlorophenyl)-methyl-sulfamoyl]benzoic acid [2-(1,2-dimethylpropylamino)-2-keto-ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)C(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N(C)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H25ClN2O5S/c1-14(2)15(3)23-20(25)13-29-21(26)16-7-5-10-19(11-16)30(27,28)24(4)18-9-6-8-17(22)12-18/h5-12,14-15H,13H2,1-4H3,(H,23,25)