[6-(2-acetamido-4-chloranyl-phenyl)sulfanyl-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate

Systemtic Name: [6-(2-acetamido-4-chloranyl-phenyl)sulfanyl-3,4,5-triacetyloxy-oxan-2-yl]methyl ethanoate Openeye Name: [6-(2-acetamido-4-chloro-phenyl)sulfanyl-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [6-[(2-acetamido-4-chlorophenyl)thio]-3,4,5-triacetyloxy-2-oxanyl]methyl ester IUPAC Name: [6-(2-acetamido-4-chlorophenyl)sulfanyl-3,4,5-triacetyloxyoxan-2-yl]methyl acetate Traditional Name: acetic acid [6-[(2-acetamido-4-chloro-phenyl)thio]-3,4,5-triacetoxy-tetrahydropyran-2-yl]methyl ester Formula: C22H26ClNO10S MolecularWeight: 531.96054

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)Cl)SC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)Cl)SC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

InChI

InChI=1S/C22H26ClNO10S/c1-10(25)24-16-8-15(23)6-7-18(16)35-22-21(33-14(5)29)20(32-13(4)28)19(31-12(3)27)17(34-22)9-30-11(2)26/h6-8,17,19-22H,9H2,1-5H3,(H,24,25)