2-oxidanyl-3-[2-(8-phenyloctyl)phenyl]-2-thiophen-2-yl-propanoic acid

Systemtic Name: 2-oxidanyl-3-[2-(8-phenyloctyl)phenyl]-2-thiophen-2-yl-propanoic acid Openeye Name: 2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-2-(2-thienyl)propanoic acid CAS Name: 2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-2-thiophen-2-ylpropanoic acid IUPAC Name: 2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-2-thiophen-2-ylpropanoic acid Traditional Name: 2-hydroxy-3-[2-(8-phenyloctyl)phenyl]-2-(2-thienyl)propionic acid Formula: C27H32O3S MolecularWeight: 436.60618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2CC(C3=CC=CS3)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCC2=CC=CC=C2CC(C3=CC=CS3)(C(=O)O)O

InChI

InChI=1S/C27H32O3S/c28-26(29)27(30,25-19-12-20-31-25)21-24-18-11-10-17-23(24)16-9-4-2-1-3-6-13-22-14-7-5-8-15-22/h5,7-8,10-12,14-15,17-20,30H,1-4,6,9,13,16,21H2,(H,28,29)