2-(4-pentan-2-ylphenyl)ethanoic acid

Systemtic Name: 2-(4-pentan-2-ylphenyl)ethanoic acid Openeye Name: 2-[4-(1-methylbutyl)phenyl]acetic acid CAS Name: 2-(4-pentan-2-ylphenyl)acetic acid IUPAC Name: 2-(4-pentan-2-ylphenyl)acetic acid Traditional Name: 2-[4-(1-methylbutyl)phenyl]acetic acid Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=C(C=C1)CC(=O)O

Isomeric SMILES

CCCC(C)C1=CC=C(C=C1)CC(=O)O

InChI

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