methyl (2R)-4-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(7-hydroxy-2-oxo-chromen-4-yl)methyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(7-hydroxy-2-oxochromen-4-yl)methyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(7-hydroxy-2-keto-chromen-4-yl)methyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C16H17NO5S/c1-21-16(20)14-9-17(4-5-23-14)8-10-6-15(19)22-13-7-11(18)2-3-12(10)13/h2-3,6-7,14,18H,4-5,8-9H2,1H3/t14-/m1/s1