1,3-benzodioxol-5-ylmethyl 4-chloranyl-3-[(4-methoxyphenyl)sulfamoyl]benzoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 4-chloranyl-3-[(4-methoxyphenyl)sulfamoyl]benzoate Openeye Name: 1,3-benzodioxol-5-ylmethyl 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoate CAS Name: 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 4-chloro-3-[(4-methoxyphenyl)sulfamoyl]benzoic acid piperonyl ester Formula: C22H18ClNO7S MolecularWeight: 475.89882

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C22H18ClNO7S/c1-28-17-6-4-16(5-7-17)24-32(26,27)21-11-15(3-8-18(21)23)22(25)29-12-14-2-9-19-20(10-14)31-13-30-19/h2-11,24H,12-13H2,1H3