2-(4-butoxy-3-methyl-phenyl)ethanoic acid

Systemtic Name: 2-(4-butoxy-3-methyl-phenyl)ethanoic acid Openeye Name: 2-(4-butoxy-3-methyl-phenyl)acetic acid CAS Name: 2-(4-butoxy-3-methylphenyl)acetic acid IUPAC Name: 2-(4-butoxy-3-methylphenyl)acetic acid Traditional Name: 2-(4-butoxy-3-methyl-phenyl)acetic acid Formula: C13H18O3 MolecularWeight: 222.28022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CC(=O)O)C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CC(=O)O)C

InChI

InChI=1S/C13H18O3/c1-3-4-7-16-12-6-5-11(8-10(12)2)9-13(14)15/h5-6,8H,3-4,7,9H2,1-2H3,(H,14,15)