[(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate

Systemtic Name: [(1R)-2-methoxy-2-oxidanylidene-1-phenyl-ethyl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate Openeye Name: [(1R)-2-methoxy-2-oxo-1-phenyl-ethyl] 2-[(3-methylisoxazol-5-yl)methylsulfanyl]benzoate CAS Name: 2-[(3-methyl-5-isoxazolyl)methylthio]benzoic acid [(1R)-2-methoxy-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-methoxy-2-oxo-1-phenylethyl] 2-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]benzoate Traditional Name: 2-[(3-methylisoxazol-5-yl)methylthio]benzoic acid [(1R)-2-keto-2-methoxy-1-phenyl-ethyl] ester Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)OC(C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=NOC(=C1)CSC2=CC=CC=C2C(=O)O[C@H](C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H19NO5S/c1-14-12-16(27-22-14)13-28-18-11-7-6-10-17(18)20(23)26-19(21(24)25-2)15-8-4-3-5-9-15/h3-12,19H,13H2,1-2H3/t19-/m1/s1