methyl 3-acetyloxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-phenylsulfanyl-propanoate

Systemtic Name: methyl 3-acetyloxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-phenylsulfanyl-propanoate Openeye Name: methyl 3-acetoxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-phenylsulfanyl-propanoate CAS Name: 3-acetyloxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-(phenylthio)propanoic acid methyl ester IUPAC Name: methyl 3-acetyloxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-phenylsulfanylpropanoate Traditional Name: 3-acetoxy-3-[(2R,3S)-2-[(3R)-1,4-dioxaspiro[4.5]decan-3-yl]-1,4-dioxaspiro[4.5]decan-3-yl]-2-(phenylthio)propionic acid methyl ester Formula: C28H38O8S MolecularWeight: 534.66152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC(C1C(OC2(O1)CCCCC2)C3COC4(O3)CCCCC4)C(C(=O)OC)SC5=CC=CC=C5

Isomeric SMILES

CC(=O)OC([C@@H]1[C@H](OC2(O1)CCCCC2)[C@H]3COC4(O3)CCCCC4)C(C(=O)OC)SC5=CC=CC=C5

InChI

InChI=1S/C28H38O8S/c1-19(29)33-24(25(26(30)31-2)37-20-12-6-3-7-13-20)23-22(35-28(36-23)16-10-5-11-17-28)21-18-32-27(34-21)14-8-4-9-15-27/h3,6-7,12-13,21-25H,4-5,8-11,14-18H2,1-2H3/t21-,22-,23+,24?,25?/m1/s1