5-(3-ethylphenyl)pentanoic acid

Systemtic Name: 5-(3-ethylphenyl)pentanoic acid Openeye Name: 5-(3-ethylphenyl)pentanoic acid CAS Name: 5-(3-ethylphenyl)pentanoic acid IUPAC Name: 5-(3-ethylphenyl)pentanoic acid Traditional Name: 5-(3-ethylphenyl)valeric acid Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)CCCCC(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)CCCCC(=O)O

InChI

InChI=1S/C13H18O2/c1-2-11-7-5-8-12(10-11)6-3-4-9-13(14)15/h5,7-8,10H,2-4,6,9H2,1H3,(H,14,15)