2-butan-2-yl-4-[(4-methoxyphenyl)methylsulfanyl]-6-phenyl-hexanoic acid

Systemtic Name: 2-butan-2-yl-4-[(4-methoxyphenyl)methylsulfanyl]-6-phenyl-hexanoic acid Openeye Name: 4-[(4-methoxyphenyl)methylsulfanyl]-6-phenyl-2-sec-butyl-hexanoic acid CAS Name: 2-butan-2-yl-4-[(4-methoxyphenyl)methylthio]-6-phenylhexanoic acid IUPAC Name: 2-butan-2-yl-4-[(4-methoxyphenyl)methylsulfanyl]-6-phenylhexanoic acid Traditional Name: 4-(p-anisylthio)-6-phenyl-2-sec-butyl-hexanoic acid Formula: C24H32O3S MolecularWeight: 400.57408

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CC(CCC1=CC=CC=C1)SCC2=CC=C(C=C2)OC)C(=O)O

Isomeric SMILES

CCC(C)C(CC(CCC1=CC=CC=C1)SCC2=CC=C(C=C2)OC)C(=O)O

InChI

InChI=1S/C24H32O3S/c1-4-18(2)23(24(25)26)16-22(15-12-19-8-6-5-7-9-19)28-17-20-10-13-21(27-3)14-11-20/h5-11,13-14,18,22-23H,4,12,15-17H2,1-3H3,(H,25,26)