[2-oxidanylidene-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl] (2R)-2-phenylsulfanylpropanoate

Systemtic Name: [2-oxidanylidene-2-(3-oxidanylidene-4H-1,4-benzoxazin-6-yl)ethyl] (2R)-2-phenylsulfanylpropanoate Openeye Name: [2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid [2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] ester IUPAC Name: [2-oxo-2-(3-oxo-4H-1,4-benzoxazin-6-yl)ethyl] (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid [2-keto-2-(3-keto-4H-1,4-benzoxazin-6-yl)ethyl] ester Formula: C19H17NO5S MolecularWeight: 371.40698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=CC=CC=C3

Isomeric SMILES

C[C@H](C(=O)OCC(=O)C1=CC2=C(C=C1)OCC(=O)N2)SC3=CC=CC=C3

InChI

InChI=1S/C19H17NO5S/c1-12(26-14-5-3-2-4-6-14)19(23)25-10-16(21)13-7-8-17-15(9-13)20-18(22)11-24-17/h2-9,12H,10-11H2,1H3,(H,20,22)/t12-/m1/s1