methyl 2-[1,3-benzodioxol-5-ylmethyl-[3-(oxidanylamino)-3-oxidanylidene-propyl]sulfamoyl]benzoate

Systemtic Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[3-(oxidanylamino)-3-oxidanylidene-propyl]sulfamoyl]benzoate Openeye Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[3-(hydroxyamino)-3-oxo-propyl]sulfamoyl]benzoate CAS Name: 2-[1,3-benzodioxol-5-ylmethyl-[3-(hydroxyamino)-3-oxopropyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 2-[1,3-benzodioxol-5-ylmethyl-[3-(hydroxyamino)-3-oxopropyl]sulfamoyl]benzoate Traditional Name: 2-[[3-(hydroxyamino)-3-keto-propyl]-piperonyl-sulfamoyl]benzoic acid methyl ester Formula: C19H20N2O8S MolecularWeight: 436.4357

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N(CCC(=O)NO)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N(CCC(=O)NO)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20N2O8S/c1-27-19(23)14-4-2-3-5-17(14)30(25,26)21(9-8-18(22)20-24)11-13-6-7-15-16(10-13)29-12-28-15/h2-7,10,24H,8-9,11-12H2,1H3,(H,20,22)