dimethyl (E)-2-[acetamido-[(2S,3R,4S)-3-acetyloxy-2-methyl-6-oxidanylidene-oxan-4-yl]amino]but-2-enedioate

Systemtic Name: dimethyl (E)-2-[acetamido-[(2S,3R,4S)-3-acetyloxy-2-methyl-6-oxidanylidene-oxan-4-yl]amino]but-2-enedioate Openeye Name: dimethyl (E)-2-[acetamido-[(2S,3R,4S)-3-acetoxy-2-methyl-6-oxo-tetrahydropyran-4-yl]amino]but-2-enedioate CAS Name: (E)-2-[acetamido-[(2S,3R,4S)-3-acetyloxy-2-methyl-6-oxo-4-oxanyl]amino]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl (E)-2-[acetamido-[(2S,3R,4S)-3-acetyloxy-2-methyl-6-oxooxan-4-yl]amino]but-2-enedioate Traditional Name: (E)-2-[acetamido-[(2S,3R,4S)-3-acetoxy-6-keto-2-methyl-tetrahydropyran-4-yl]amino]but-2-enedioic acid dimethyl ester Formula: C16H22N2O9 MolecularWeight: 386.35388

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(=O)O1)N(C(=CC(=O)OC)C(=O)OC)NC(=O)C)OC(=O)C

Isomeric SMILES

C[C@H]1[C@@H]([C@H](CC(=O)O1)N(/C(=C/C(=O)OC)/C(=O)OC)NC(=O)C)OC(=O)C

InChI

InChI=1S/C16H22N2O9/c1-8-15(27-10(3)20)11(6-14(22)26-8)18(17-9(2)19)12(16(23)25-5)7-13(21)24-4/h7-8,11,15H,6H2,1-5H3,(H,17,19)/b12-7+/t8-,11-,15-/m0/s1