pentyl 3-methyl-5-phenyl-octanoate

Systemtic Name: pentyl 3-methyl-5-phenyl-octanoate Openeye Name: pentyl 3-methyl-5-phenyl-octanoate CAS Name: 3-methyl-5-phenyloctanoic acid pentyl ester IUPAC Name: pentyl 3-methyl-5-phenyloctanoate Traditional Name: 3-methyl-5-phenyl-caprylic acid amyl ester Formula: C20H32O2 MolecularWeight: 304.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CC(C)CC(CCC)C1=CC=CC=C1

Isomeric SMILES

CCCCCOC(=O)CC(C)CC(CCC)C1=CC=CC=C1

InChI

InChI=1S/C20H32O2/c1-4-6-10-14-22-20(21)16-17(3)15-19(11-5-2)18-12-8-7-9-13-18/h7-9,12-13,17,19H,4-6,10-11,14-16H2,1-3H3