methyl (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-oxidanyl-methyl]-2-methoxy-4-oxidanyl-oxane-2-carboxylate

Systemtic Name: methyl (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-oxidanyl-methyl]-2-methoxy-4-oxidanyl-oxane-2-carboxylate Openeye Name: methyl (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxy-methyl]-4-hydroxy-2-methoxy-tetrahydropyran-2-carboxylate CAS Name: (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxymethyl]-4-hydroxy-2-methoxy-2-oxanecarboxylic acid methyl ester IUPAC Name: methyl (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxymethyl]-4-hydroxy-2-methoxyoxane-2-carboxylate Traditional Name: (2S,4R,5S,6R)-5-acetamido-4-(cyanomethyl)-6-[(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-hydroxy-methyl]-4-hydroxy-2-methoxy-tetrahydropyran-2-carboxylic acid methyl ester Formula: C18H28N2O9 MolecularWeight: 416.42292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(OC(CC1(CC#N)O)(C(=O)OC)OC)C(C2COC(O2)(C)C)O

Isomeric SMILES

CC(=O)N[C@H]1[C@@H](O[C@@](C[C@@]1(CC#N)O)(C(=O)OC)OC)[C@@H]([C@H]2COC(O2)(C)C)O

InChI

InChI=1S/C18H28N2O9/c1-10(21)20-14-13(12(22)11-8-27-16(2,3)28-11)29-18(26-5,15(23)25-4)9-17(14,24)6-7-19/h11-14,22,24H,6,8-9H2,1-5H3,(H,20,21)/t11-,12-,13+,14+,17-,18+/m1/s1