2-[3-(3-cyclopentyl-2-phenylmethoxy-phenyl)-2-oxidanyl-3-propylsulfanyl-propoxy]ethanoic acid

Systemtic Name: 2-[3-(3-cyclopentyl-2-phenylmethoxy-phenyl)-2-oxidanyl-3-propylsulfanyl-propoxy]ethanoic acid Openeye Name: 2-[3-(2-benzyloxy-3-cyclopentyl-phenyl)-2-hydroxy-3-propylsulfanyl-propoxy]acetic acid CAS Name: 2-[3-(3-cyclopentyl-2-phenylmethoxyphenyl)-2-hydroxy-3-(propylthio)propoxy]acetic acid IUPAC Name: 2-[3-(3-cyclopentyl-2-phenylmethoxyphenyl)-2-hydroxy-3-propylsulfanylpropoxy]acetic acid Traditional Name: 2-[3-(2-benzoxy-3-cyclopentyl-phenyl)-2-hydroxy-3-(propylthio)propoxy]acetic acid Formula: C26H34O5S MolecularWeight: 458.61016

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC(C1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)C(COCC(=O)O)O

Isomeric SMILES

CCCSC(C1=CC=CC(=C1OCC2=CC=CC=C2)C3CCCC3)C(COCC(=O)O)O

InChI

InChI=1S/C26H34O5S/c1-2-15-32-26(23(27)17-30-18-24(28)29)22-14-8-13-21(20-11-6-7-12-20)25(22)31-16-19-9-4-3-5-10-19/h3-5,8-10,13-14,20,23,26-27H,2,6-7,11-12,15-18H2,1H3,(H,28,29)