methyl 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propyl-phenoxy]ethanoate

Systemtic Name: methyl 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propyl-phenoxy]ethanoate Openeye Name: methyl 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propyl-phenoxy]acetate CAS Name: 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propylphenoxy]acetic acid methyl ester IUPAC Name: methyl 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propylphenoxy]acetate Traditional Name: 2-(3H-1,2-benzodioxol-6-yl)-2-[4-(methylcarbamoylsulfamoyl)-2-propyl-phenoxy]acetic acid methyl ester Formula: C21H24N2O8S MolecularWeight: 464.48886

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)NC(=O)NC)OC(C2=CC3=C(COO3)C=C2)C(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)NC(=O)NC)OC(C2=CC3=C(COO3)C=C2)C(=O)OC

InChI

InChI=1S/C21H24N2O8S/c1-4-5-13-10-16(32(26,27)23-21(25)22-2)8-9-17(13)30-19(20(24)28-3)14-6-7-15-12-29-31-18(15)11-14/h6-11,19H,4-5,12H2,1-3H3,(H2,22,23,25)