ethyl 3-azanyl-2-cyano-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]sulfanyl-prop-2-enoate

Systemtic Name: ethyl 3-azanyl-2-cyano-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]sulfanyl-prop-2-enoate Openeye Name: ethyl 3-amino-2-cyano-3-[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]sulfanyl-prop-2-enoate CAS Name: 3-amino-2-cyano-3-[[3,4,5-triacetyloxy-6-(acetyloxymethyl)-2-oxanyl]thio]-2-propenoic acid ethyl ester IUPAC Name: ethyl 3-amino-2-cyano-3-[3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]sulfanylprop-2-enoate Traditional Name: 3-amino-2-cyano-3-[[3,4,5-triacetoxy-6-(acetoxymethyl)tetrahydropyran-2-yl]thio]acrylic acid ethyl ester Formula: C20H26N2O11S MolecularWeight: 502.49224

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(N)SC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C#N

Isomeric SMILES

CCOC(=O)C(=C(N)SC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C)C#N

InChI

InChI=1S/C20H26N2O11S/c1-6-28-19(27)13(7-21)18(22)34-20-17(32-12(5)26)16(31-11(4)25)15(30-10(3)24)14(33-20)8-29-9(2)23/h14-17,20H,6,8,22H2,1-5H3