6-[5-(phenylmethyl)thiophen-2-yl]hexanoic acid

Systemtic Name: 6-[5-(phenylmethyl)thiophen-2-yl]hexanoic acid Openeye Name: 6-(5-benzyl-2-thienyl)hexanoic acid CAS Name: 6-[5-(phenylmethyl)-2-thiophenyl]hexanoic acid IUPAC Name: 6-(5-benzylthiophen-2-yl)hexanoic acid Traditional Name: 6-(5-benzyl-2-thienyl)hexanoic acid Formula: C17H20O2S MolecularWeight: 288.4045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=C(S2)CCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=C(S2)CCCCCC(=O)O

InChI

InChI=1S/C17H20O2S/c18-17(19)10-6-2-5-9-15-11-12-16(20-15)13-14-7-3-1-4-8-14/h1,3-4,7-8,11-12H,2,5-6,9-10,13H2,(H,18,19)