7-[5-(4-phenylbutyl)thiophen-2-yl]heptanoic acid

Systemtic Name: 7-[5-(4-phenylbutyl)thiophen-2-yl]heptanoic acid Openeye Name: 7-[5-(4-phenylbutyl)-2-thienyl]heptanoic acid CAS Name: 7-[5-(4-phenylbutyl)-2-thiophenyl]heptanoic acid IUPAC Name: 7-[5-(4-phenylbutyl)thiophen-2-yl]heptanoic acid Traditional Name: 7-[5-(4-phenylbutyl)-2-thienyl]enanthic acid Formula: C21H28O2S MolecularWeight: 344.51082

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=CC=C(S2)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=CC=C(S2)CCCCCCC(=O)O

InChI

InChI=1S/C21H28O2S/c22-21(23)15-7-2-1-6-13-19-16-17-20(24-19)14-9-8-12-18-10-4-3-5-11-18/h3-5,10-11,16-17H,1-2,6-9,12-15H2,(H,22,23)