methyl (2R)-4-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[1-oxo-4-(2-oxo-1,3-benzoxazol-3-yl)butyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[4-(2-oxo-1,3-benzoxazol-3-yl)butanoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[4-(2-keto-1,3-benzoxazol-3-yl)butanoyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H20N2O5S MolecularWeight: 364.4161

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)CCCN2C3=CC=CC=C3OC2=O

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)CCCN2C3=CC=CC=C3OC2=O

InChI

InChI=1S/C17H20N2O5S/c1-23-16(21)14-11-18(9-10-25-14)15(20)7-4-8-19-12-5-2-3-6-13(12)24-17(19)22/h2-3,5-6,14H,4,7-11H2,1H3/t14-/m1/s1