ethyl 3-[3-(3-cyclopentyl-2-phenylmethoxy-phenyl)-2-oxidanyl-propyl]sulfanylpropanoate

Systemtic Name: ethyl 3-[3-(3-cyclopentyl-2-phenylmethoxy-phenyl)-2-oxidanyl-propyl]sulfanylpropanoate Openeye Name: ethyl 3-[3-(2-benzyloxy-3-cyclopentyl-phenyl)-2-hydroxy-propyl]sulfanylpropanoate CAS Name: 3-[[3-(3-cyclopentyl-2-phenylmethoxyphenyl)-2-hydroxypropyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-(3-cyclopentyl-2-phenylmethoxyphenyl)-2-hydroxypropyl]sulfanylpropanoate Traditional Name: 3-[[3-(2-benzoxy-3-cyclopentyl-phenyl)-2-hydroxy-propyl]thio]propionic acid ethyl ester Formula: C26H34O4S MolecularWeight: 442.61076

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSCC(CC1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)O

Isomeric SMILES

CCOC(=O)CCSCC(CC1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)O

InChI

InChI=1S/C26H34O4S/c1-2-29-25(28)15-16-31-19-23(27)17-22-13-8-14-24(21-11-6-7-12-21)26(22)30-18-20-9-4-3-5-10-20/h3-5,8-10,13-14,21,23,27H,2,6-7,11-12,15-19H2,1H3