2-methyl-7-[3-(3-phenylpropyl)thiophen-2-yl]heptanoic acid

Systemtic Name: 2-methyl-7-[3-(3-phenylpropyl)thiophen-2-yl]heptanoic acid Openeye Name: 2-methyl-7-[3-(3-phenylpropyl)-2-thienyl]heptanoic acid CAS Name: 2-methyl-7-[3-(3-phenylpropyl)-2-thiophenyl]heptanoic acid IUPAC Name: 2-methyl-7-[3-(3-phenylpropyl)thiophen-2-yl]heptanoic acid Traditional Name: 2-methyl-7-[3-(3-phenylpropyl)-2-thienyl]enanthic acid Formula: C21H28O2S MolecularWeight: 344.51082

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCC1=C(C=CS1)CCCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(CCCCCC1=C(C=CS1)CCCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C21H28O2S/c1-17(21(22)23)9-4-2-7-14-20-19(15-16-24-20)13-8-12-18-10-5-3-6-11-18/h3,5-6,10-11,15-17H,2,4,7-9,12-14H2,1H3,(H,22,23)