2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanyl-propanoic acid

Systemtic Name: 2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanyl-propanoic acid Openeye Name: 2-[4-[2-(5-benzyloxyindol-1-yl)ethoxy]phenyl]sulfanyl-2-methyl-propanoic acid CAS Name: 2-methyl-2-[[4-[2-(5-phenylmethoxy-1-indolyl)ethoxy]phenyl]thio]propanoic acid IUPAC Name: 2-methyl-2-[4-[2-(5-phenylmethoxyindol-1-yl)ethoxy]phenyl]sulfanylpropanoic acid Traditional Name: 2-[[4-[2-(5-benzoxyindol-1-yl)ethoxy]phenyl]thio]-2-methyl-propionic acid Formula: C27H27NO4S MolecularWeight: 461.57258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C(=O)O)SC1=CC=C(C=C1)OCCN2C=CC3=C2C=CC(=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H27NO4S/c1-27(2,26(29)30)33-24-11-8-22(9-12-24)31-17-16-28-15-14-21-18-23(10-13-25(21)28)32-19-20-6-4-3-5-7-20/h3-15,18H,16-17,19H2,1-2H3,(H,29,30)