[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[methyl-(phenylmethyl)sulfamoyl]benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 5-[benzyl(methyl)sulfamoyl]-2-chlorobenzoate Traditional Name: 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C22H27ClN2O5S MolecularWeight: 466.97818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27ClN2O5S/c1-4-17(5-2)24-21(26)15-30-22(27)19-13-18(11-12-20(19)23)31(28,29)25(3)14-16-9-7-6-8-10-16/h6-13,17H,4-5,14-15H2,1-3H3,(H,24,26)