2-(4-methoxyphenyl)sulfanyl-5-phenyl-pentanoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfanyl-5-phenyl-pentanoic acid Openeye Name: 2-(4-methoxyphenyl)sulfanyl-5-phenyl-pentanoic acid CAS Name: 2-[(4-methoxyphenyl)thio]-5-phenylpentanoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfanyl-5-phenylpentanoic acid Traditional Name: 2-[(4-methoxyphenyl)thio]-5-phenyl-valeric acid Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)SC(CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)SC(CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H20O3S/c1-21-15-10-12-16(13-11-15)22-17(18(19)20)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-13,17H,5,8-9H2,1H3,(H,19,20)