1,3-benzothiazol-2-ylmethyl 4-methoxy-3-sulfamoyl-benzoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 4-methoxy-3-sulfamoyl-benzoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 4-methoxy-3-sulfamoyl-benzoate CAS Name: 4-methoxy-3-sulfamoylbenzoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 4-methoxy-3-sulfamoylbenzoate Traditional Name: 4-methoxy-3-sulfamoyl-benzoic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C16H14N2O5S2 MolecularWeight: 378.42276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC2=NC3=CC=CC=C3S2)S(=O)(=O)N

InChI

InChI=1S/C16H14N2O5S2/c1-22-12-7-6-10(8-14(12)25(17,20)21)16(19)23-9-15-18-11-4-2-3-5-13(11)24-15/h2-8H,9H2,1H3,(H2,17,20,21)