2-hexylsulfanyl-2-(3-phenoxyphenyl)ethanoic acid

Systemtic Name: 2-hexylsulfanyl-2-(3-phenoxyphenyl)ethanoic acid Openeye Name: 2-hexylsulfanyl-2-(3-phenoxyphenyl)acetic acid CAS Name: 2-(hexylthio)-2-(3-phenoxyphenyl)acetic acid IUPAC Name: 2-hexylsulfanyl-2-(3-phenoxyphenyl)acetic acid Traditional Name: 2-(hexylthio)-2-(3-phenoxyphenyl)acetic acid Formula: C20H24O3S MolecularWeight: 344.46776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCSC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C20H24O3S/c1-2-3-4-8-14-24-19(20(21)22)16-10-9-13-18(15-16)23-17-11-6-5-7-12-17/h5-7,9-13,15,19H,2-4,8,14H2,1H3,(H,21,22)