2-[3-[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(3-methoxyphenyl)sulfanyl-2-oxidanyl-propyl]sulfanylethanoate

Systemtic Name: 2-[3-[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl]-3-(3-methoxyphenyl)sulfanyl-2-oxidanyl-propyl]sulfanylethanoate Openeye Name: 2-[3-[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl]-2-hydroxy-3-(3-methoxyphenyl)sulfanyl-propyl]sulfanylacetate CAS Name: 2-[[3-[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl]-2-hydroxy-3-[(3-methoxyphenyl)thio]propyl]thio]acetate IUPAC Name: 2-[3-[3-cyclopentyl-2-[(4-methoxyphenyl)methoxy]phenyl]-2-hydroxy-3-(3-methoxyphenyl)sulfanylpropyl]sulfanylacetate Traditional Name: 2-[[3-(3-cyclopentyl-2-p-anisyloxy-phenyl)-2-hydroxy-3-[(3-methoxyphenyl)thio]propyl]thio]acetate Formula: C31H35O6S2- MolecularWeight: 567.736

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)COC2=C(C=CC=C2C(C(CSCC(=O)[O-])O)SC3=CC=CC(=C3)OC)C4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)COC2=C(C=CC=C2C(C(CSCC(=O)[O-])O)SC3=CC=CC(=C3)OC)C4CCCC4

InChI

InChI=1S/C31H36O6S2/c1-35-23-15-13-21(14-16-23)18-37-30-26(22-7-3-4-8-22)11-6-12-27(30)31(28(32)19-38-20-29(33)34)39-25-10-5-9-24(17-25)36-2/h5-6,9-17,22,28,31-32H,3-4,7-8,18-20H2,1-2H3,(H,33,34)/p-1