[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(tert-butylsulfamoyl)-2-methyl-benzoate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 5-(tert-butylsulfamoyl)-2-methyl-benzoate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 5-(tert-butylsulfamoyl)-2-methyl-benzoate CAS Name: 5-(tert-butylsulfamoyl)-2-methylbenzoic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 5-(tert-butylsulfamoyl)-2-methylbenzoate Traditional Name: 5-(tert-butylsulfamoyl)-2-methyl-benzoic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C21H23NO7S MolecularWeight: 433.47482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)C(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC(C)(C)C)C(=O)OCC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H23NO7S/c1-13-5-7-15(30(25,26)22-21(2,3)4)10-16(13)20(24)27-11-17(23)14-6-8-18-19(9-14)29-12-28-18/h5-10,22H,11-12H2,1-4H3