7-(5-phenethylthiophen-3-yl)heptanoic acid

Systemtic Name: 7-(5-phenethylthiophen-3-yl)heptanoic acid Openeye Name: 7-(5-phenethyl-3-thienyl)heptanoic acid CAS Name: 7-(5-phenethyl-3-thiophenyl)heptanoic acid IUPAC Name: 7-(5-phenethylthiophen-3-yl)heptanoic acid Traditional Name: 7-(5-phenethyl-3-thienyl)enanthic acid Formula: C19H24O2S MolecularWeight: 316.45766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC(=CS2)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC(=CS2)CCCCCCC(=O)O

InChI

InChI=1S/C19H24O2S/c20-19(21)11-7-2-1-4-10-17-14-18(22-15-17)13-12-16-8-5-3-6-9-16/h3,5-6,8-9,14-15H,1-2,4,7,10-13H2,(H,20,21)