(4-methylphenyl) octanoate

Systemtic Name: (4-methylphenyl) octanoate Openeye Name: p-tolyl octanoate CAS Name: octanoic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) octanoate Traditional Name: caprylic acid p-tolyl ester Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22O2/c1-3-4-5-6-7-8-15(16)17-14-11-9-13(2)10-12-14/h9-12H,3-8H2,1-2H3