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

Systemtic Name: (2-butoxy-2-oxidanylidene-ethyl) 2-chloranyl-5-[methyl-(phenylmethyl)sulfamoyl]benzoate Openeye Name: (2-butoxy-2-oxo-ethyl) 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoate CAS Name: 2-chloro-5-[methyl-(phenylmethyl)sulfamoyl]benzoic acid (2-butoxy-2-oxoethyl) ester IUPAC Name: (2-butoxy-2-oxoethyl) 5-[benzyl(methyl)sulfamoyl]-2-chlorobenzoate Traditional Name: 5-[benzyl(methyl)sulfamoyl]-2-chloro-benzoic acid (2-butoxy-2-keto-ethyl) ester Formula: C21H24ClNO6S MolecularWeight: 453.93636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO6S/c1-3-4-12-28-20(24)15-29-21(25)18-13-17(10-11-19(18)22)30(26,27)23(2)14-16-8-6-5-7-9-16/h5-11,13H,3-4,12,14-15H2,1-2H3