phenethyl pentanoate

Systemtic Name: phenethyl pentanoate Openeye Name: phenethyl pentanoate CAS Name: pentanoic acid phenethyl ester IUPAC Name: phenethyl pentanoate Traditional Name: valeric acid phenethyl ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OCCC1=CC=CC=C1

Isomeric SMILES

CCCCC(=O)OCCC1=CC=CC=C1

InChI

InChI=1S/C13H18O2/c1-2-3-9-13(14)15-11-10-12-7-5-4-6-8-12/h4-8H,2-3,9-11H2,1H3