4-(3-phenylpropylsulfanyl)benzoic acid

Systemtic Name: 4-(3-phenylpropylsulfanyl)benzoic acid Openeye Name: 4-(3-phenylpropylsulfanyl)benzoic acid CAS Name: 4-(3-phenylpropylthio)benzoic acid IUPAC Name: 4-(3-phenylpropylsulfanyl)benzoic acid Traditional Name: 4-(3-phenylpropylthio)benzoic acid Formula: C16H16O2S MolecularWeight: 272.36204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCSC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H16O2S/c17-16(18)14-8-10-15(11-9-14)19-12-4-7-13-5-2-1-3-6-13/h1-3,5-6,8-11H,4,7,12H2,(H,17,18)