heptadecyl 3-phenylpropanoate

Systemtic Name: heptadecyl 3-phenylpropanoate Openeye Name: heptadecyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid heptadecyl ester IUPAC Name: heptadecyl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid heptadecyl ester Formula: C26H44O2 MolecularWeight: 388.62636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCOC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCOC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C26H44O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-28-26(27)23-22-25-20-17-16-18-21-25/h16-18,20-21H,2-15,19,22-24H2,1H3