(phenylmethyl) (4R)-2-azanyl-6-(hydroxymethyl)-8-oxidanylidene-4-pyridin-3-yl-4H-pyrano[3,2-b]pyran-3-carboxylate

Systemtic Name: (phenylmethyl) (4R)-2-azanyl-6-(hydroxymethyl)-8-oxidanylidene-4-pyridin-3-yl-4H-pyrano[3,2-b]pyran-3-carboxylate Openeye Name: benzyl (4R)-2-amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridyl)-4H-pyrano[3,2-b]pyran-3-carboxylate CAS Name: (4R)-2-amino-6-(hydroxymethyl)-8-oxo-4-(3-pyridinyl)-4H-pyrano[3,2-b]pyran-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4R)-2-amino-6-(hydroxymethyl)-8-oxo-4-pyridin-3-yl-4H-pyrano[3,2-b]pyran-3-carboxylate Traditional Name: (4R)-2-amino-8-keto-6-methylol-4-(3-pyridyl)-4H-pyrano[3,2-b]pyran-3-carboxylic acid benzyl ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C2=C(OC3=C(C2C4=CN=CC=C4)OC(=CC3=O)CO)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C2=C(OC3=C([C@@H]2C4=CN=CC=C4)OC(=CC3=O)CO)N

InChI

InChI=1S/C22H18N2O6/c23-21-18(22(27)28-12-13-5-2-1-3-6-13)17(14-7-4-8-24-10-14)20-19(30-21)16(26)9-15(11-25)29-20/h1-10,17,25H,11-12,23H2/t17-/m1/s1