5-phenylpentyl 3-methyloctanoate

Systemtic Name: 5-phenylpentyl 3-methyloctanoate Openeye Name: 5-phenylpentyl 3-methyloctanoate CAS Name: 3-methyloctanoic acid 5-phenylpentyl ester IUPAC Name: 5-phenylpentyl 3-methyloctanoate Traditional Name: 3-methylcaprylic acid 5-phenylpentyl ester Formula: C20H32O2 MolecularWeight: 304.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CC(=O)OCCCCCC1=CC=CC=C1

Isomeric SMILES

CCCCCC(C)CC(=O)OCCCCCC1=CC=CC=C1

InChI

InChI=1S/C20H32O2/c1-3-4-7-12-18(2)17-20(21)22-16-11-6-10-15-19-13-8-5-9-14-19/h5,8-9,13-14,18H,3-4,6-7,10-12,15-17H2,1-2H3