methyl 1,1,3-tris(oxidanylidene)-2-(2-oxidanyl-2-phenyl-ethyl)-1,2-benzothiazole-6-carboxylate

Systemtic Name: methyl 1,1,3-tris(oxidanylidene)-2-(2-oxidanyl-2-phenyl-ethyl)-1,2-benzothiazole-6-carboxylate Openeye Name: methyl 2-(2-hydroxy-2-phenyl-ethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate CAS Name: 2-(2-hydroxy-2-phenylethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-hydroxy-2-phenylethyl)-1,1,3-trioxo-1,2-benzothiazole-6-carboxylate Traditional Name: 2-(2-hydroxy-2-phenyl-ethyl)-1,1,3-triketo-1,2-benzothiazole-6-carboxylic acid methyl ester Formula: C17H15NO6S MolecularWeight: 361.3691

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(S2(=O)=O)CC(C3=CC=CC=C3)O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(S2(=O)=O)CC(C3=CC=CC=C3)O

InChI

InChI=1S/C17H15NO6S/c1-24-17(21)12-7-8-13-15(9-12)25(22,23)18(16(13)20)10-14(19)11-5-3-2-4-6-11/h2-9,14,19H,10H2,1H3