4-methylpentyl 3-phenylpropanoate

Systemtic Name: 4-methylpentyl 3-phenylpropanoate Openeye Name: isohexyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid isohexyl ester Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CC(C)CCCOC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C15H22O2/c1-13(2)7-6-12-17-15(16)11-10-14-8-4-3-5-9-14/h3-5,8-9,13H,6-7,10-12H2,1-2H3