(3,5-dimethylphenyl) octanoate

Systemtic Name: (3,5-dimethylphenyl) octanoate Openeye Name: (3,5-dimethylphenyl) octanoate CAS Name: octanoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) octanoate Traditional Name: caprylic acid (3,5-dimethylphenyl) ester Formula: C16H24O2 MolecularWeight: 248.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OC1=CC(=CC(=C1)C)C

Isomeric SMILES

CCCCCCCC(=O)OC1=CC(=CC(=C1)C)C

InChI

InChI=1S/C16H24O2/c1-4-5-6-7-8-9-16(17)18-15-11-13(2)10-14(3)12-15/h10-12H,4-9H2,1-3H3