[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[methyl-(phenylmethyl)sulfamoyl]benzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 5-[benzyl(methyl)sulfamoyl]-2-chlorobenzoate Traditional Name: 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)CC2=CC=CC=C2)Cl

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)CC2=CC=CC=C2)Cl

InChI

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