methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-3H-1,3-benzothiazole-2-carboxylate

Systemtic Name: methyl 2-(2-methoxy-2-oxidanylidene-ethyl)-3H-1,3-benzothiazole-2-carboxylate Openeye Name: methyl 2-(2-methoxy-2-oxo-ethyl)-3H-1,3-benzothiazole-2-carboxylate CAS Name: 2-(2-methoxy-2-oxoethyl)-3H-1,3-benzothiazole-2-carboxylic acid methyl ester IUPAC Name: methyl 2-(2-methoxy-2-oxoethyl)-3H-1,3-benzothiazole-2-carboxylate Traditional Name: 2-(2-keto-2-methoxy-ethyl)-3H-1,3-benzothiazole-2-carboxylic acid methyl ester Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1(NC2=CC=CC=C2S1)C(=O)OC

Isomeric SMILES

COC(=O)CC1(NC2=CC=CC=C2S1)C(=O)OC

InChI

InChI=1S/C12H13NO4S/c1-16-10(14)7-12(11(15)17-2)13-8-5-3-4-6-9(8)18-12/h3-6,13H,7H2,1-2H3