[5-acetamido-3-acetyloxy-2-[(2-methylphenyl)sulfonyl-oxidanyl-methyl]-6-prop-2-enoxy-oxan-4-yl] ethanoate

Systemtic Name: [5-acetamido-3-acetyloxy-2-[(2-methylphenyl)sulfonyl-oxidanyl-methyl]-6-prop-2-enoxy-oxan-4-yl] ethanoate Openeye Name: [3-acetamido-5-acetoxy-2-allyloxy-6-[hydroxy(o-tolylsulfonyl)methyl]tetrahydropyran-4-yl] acetate CAS Name: acetic acid [5-acetamido-3-acetyloxy-2-[hydroxy-(2-methylphenyl)sulfonylmethyl]-6-prop-2-enoxy-4-oxanyl] ester IUPAC Name: [5-acetamido-3-acetyloxy-2-[hydroxy-(2-methylphenyl)sulfonylmethyl]-6-prop-2-enoxyoxan-4-yl] acetate Traditional Name: acetic acid [3-acetamido-5-acetoxy-2-allyloxy-6-[hydroxy(o-tolylsulfonyl)methyl]tetrahydropyran-4-yl] ester Formula: C22H29NO10S MolecularWeight: 499.53136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)C(C2C(C(C(C(O2)OCC=C)NC(=O)C)OC(=O)C)OC(=O)C)O

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)C(C2C(C(C(C(O2)OCC=C)NC(=O)C)OC(=O)C)OC(=O)C)O

InChI

InChI=1S/C22H29NO10S/c1-6-11-30-22-17(23-13(3)24)18(31-14(4)25)19(32-15(5)26)20(33-22)21(27)34(28,29)16-10-8-7-9-12(16)2/h6-10,17-22,27H,1,11H2,2-5H3,(H,23,24)