methyl 3-[3-[3-cyclopentyl-2-[(2-methoxyphenyl)methoxy]phenyl]-2-oxidanyl-propyl]sulfanylpropanoate

Systemtic Name: methyl 3-[3-[3-cyclopentyl-2-[(2-methoxyphenyl)methoxy]phenyl]-2-oxidanyl-propyl]sulfanylpropanoate Openeye Name: methyl 3-[3-[3-cyclopentyl-2-[(2-methoxyphenyl)methoxy]phenyl]-2-hydroxy-propyl]sulfanylpropanoate CAS Name: 3-[[3-[3-cyclopentyl-2-[(2-methoxyphenyl)methoxy]phenyl]-2-hydroxypropyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[3-[3-cyclopentyl-2-[(2-methoxyphenyl)methoxy]phenyl]-2-hydroxypropyl]sulfanylpropanoate Traditional Name: 3-[[3-(3-cyclopentyl-2-o-anisyloxy-phenyl)-2-hydroxy-propyl]thio]propionic acid methyl ester Formula: C26H34O5S MolecularWeight: 458.61016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1COC2=C(C=CC=C2CC(CSCCC(=O)OC)O)C3CCCC3

Isomeric SMILES

COC1=CC=CC=C1COC2=C(C=CC=C2CC(CSCCC(=O)OC)O)C3CCCC3

InChI

InChI=1S/C26H34O5S/c1-29-24-13-6-5-10-21(24)17-31-26-20(11-7-12-23(26)19-8-3-4-9-19)16-22(27)18-32-15-14-25(28)30-2/h5-7,10-13,19,22,27H,3-4,8-9,14-18H2,1-2H3