[2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[methyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-(isopentylamino)-2-oxo-ethyl] 2-chloro-5-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 2-chloro-5-[methyl(phenyl)sulfamoyl]benzoic acid [2-(3-methylbutylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl] 2-chloro-5-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 2-chloro-5-[methyl(phenyl)sulfamoyl]benzoic acid [2-(isoamylamino)-2-keto-ethyl] ester Formula: C21H25ClN2O5S MolecularWeight: 452.9516

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25ClN2O5S/c1-15(2)11-12-23-20(25)14-29-21(26)18-13-17(9-10-19(18)22)30(27,28)24(3)16-7-5-4-6-8-16/h4-10,13,15H,11-12,14H2,1-3H3,(H,23,25)