[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 2-methyl-3-(3-methylsulfonyloxy-2-oxidanyl-propyl)sulfanyl-propanoate

Systemtic Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 2-methyl-3-(3-methylsulfonyloxy-2-oxidanyl-propyl)sulfanyl-propanoate Openeye Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 3-(2-hydroxy-3-methylsulfonyloxy-propyl)sulfanyl-2-methyl-propanoate CAS Name: 3-[(2-hydroxy-3-methylsulfonyloxypropyl)thio]-2-methylpropanoic acid [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] ester IUPAC Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 3-(2-hydroxy-3-methylsulfonyloxypropyl)sulfanyl-2-methylpropanoate Traditional Name: 3-[(2-hydroxy-3-methylsulfonyloxy-propyl)thio]-2-methyl-propionic acid (3-cyclopentyl-2-p-anisyloxy-phenyl) ester Formula: C27H36O8S2 MolecularWeight: 552.69994

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCC(COS(=O)(=O)C)O)C(=O)OC1=CC=CC(=C1OCC2=CC=C(C=C2)OC)C3CCCC3

Isomeric SMILES

CC(CSCC(COS(=O)(=O)C)O)C(=O)OC1=CC=CC(=C1OCC2=CC=C(C=C2)OC)C3CCCC3

InChI

InChI=1S/C27H36O8S2/c1-19(17-36-18-22(28)16-34-37(3,30)31)27(29)35-25-10-6-9-24(21-7-4-5-8-21)26(25)33-15-20-11-13-23(32-2)14-12-20/h6,9-14,19,21-22,28H,4-5,7-8,15-18H2,1-3H3