7-[5-(3-phenylpropyl)thiophen-3-yl]heptanoic acid

Systemtic Name: 7-[5-(3-phenylpropyl)thiophen-3-yl]heptanoic acid Openeye Name: 7-[5-(3-phenylpropyl)-3-thienyl]heptanoic acid CAS Name: 7-[5-(3-phenylpropyl)-3-thiophenyl]heptanoic acid IUPAC Name: 7-[5-(3-phenylpropyl)thiophen-3-yl]heptanoic acid Traditional Name: 7-[5-(3-phenylpropyl)-3-thienyl]enanthic acid Formula: C20H26O2S MolecularWeight: 330.48424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CC(=CS2)CCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CC(=CS2)CCCCCCC(=O)O

InChI

InChI=1S/C20H26O2S/c21-20(22)14-7-2-1-4-11-18-15-19(23-16-18)13-8-12-17-9-5-3-6-10-17/h3,5-6,9-10,15-16H,1-2,4,7-8,11-14H2,(H,21,22)