[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 2-methyl-3-(2-oxidanylpropylsulfanyl)propanoate

Systemtic Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 2-methyl-3-(2-oxidanylpropylsulfanyl)propanoate Openeye Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 3-(2-hydroxypropylsulfanyl)-2-methyl-propanoate CAS Name: 3-(2-hydroxypropylthio)-2-methylpropanoic acid [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] ester IUPAC Name: [3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl] 3-(2-hydroxypropylsulfanyl)-2-methylpropanoate Traditional Name: 3-(2-hydroxypropylthio)-2-methyl-propionic acid (3-cyclopentyl-2-p-anisyloxy-phenyl) ester Formula: C26H34O5S MolecularWeight: 458.61016

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H34O5S/c1-18(16-32-17-19(2)27)26(28)31-24-10-6-9-23(21-7-4-5-8-21)25(24)30-15-20-11-13-22(29-3)14-12-20/h6,9-14,18-19,21,27H,4-5,7-8,15-17H2,1-3H3