methyl (3S,4R)-2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carboxylate

Systemtic Name: methyl (3S,4R)-2,2-dimethyl-3-oxidanyl-4-[(2-oxidanylidene-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carboxylate Openeye Name: methyl (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]chromane-6-carboxylate CAS Name: (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl (3S,4R)-3-hydroxy-2,2-dimethyl-4-[(2-oxo-1H-pyridin-4-yl)oxy]-3,4-dihydrochromene-6-carboxylate Traditional Name: (3S,4R)-3-hydroxy-4-[(2-keto-1H-pyridin-4-yl)oxy]-2,2-dimethyl-chroman-6-carboxylic acid methyl ester Formula: C18H19NO6 MolecularWeight: 345.34656

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C(=O)OC)OC3=CC(=O)NC=C3)O)C

Isomeric SMILES

CC1([C@H]([C@@H](C2=C(O1)C=CC(=C2)C(=O)OC)OC3=CC(=O)NC=C3)O)C

InChI

InChI=1S/C18H19NO6/c1-18(2)16(21)15(24-11-6-7-19-14(20)9-11)12-8-10(17(22)23-3)4-5-13(12)25-18/h4-9,15-16,21H,1-3H3,(H,19,20)/t15-,16+/m1/s1