1,3-benzothiazol-2-ylmethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-oxidanyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-oxidanyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoate CAS Name: 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoate Traditional Name: 2-hydroxy-5-[(4-methoxyphenyl)sulfamoyl]benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C22H18N2O6S2 MolecularWeight: 470.51812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)O)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H18N2O6S2/c1-29-15-8-6-14(7-9-15)24-32(27,28)16-10-11-19(25)17(12-16)22(26)30-13-21-23-18-4-2-3-5-20(18)31-21/h2-12,24-25H,13H2,1H3