[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: [(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: [(1R)-2-methoxy-2-oxo-1-phenyl-ethyl] 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid [(1R)-2-methoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-methoxy-2-oxo-1-phenylethyl] 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid [(1R)-2-keto-2-methoxy-1-phenyl-ethyl] ester Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=CC=C1)OC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)[C@@H](C1=CC=CC=C1)OC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H19NO4S/c1-24-20(23)19(14-8-3-2-4-9-14)25-18(22)13-7-12-17-21-15-10-5-6-11-16(15)26-17/h2-6,8-11,19H,7,12-13H2,1H3/t19-/m1/s1