hexadecan-4-yl 3-phenylpropanoate

Systemtic Name: hexadecan-4-yl 3-phenylpropanoate Openeye Name: 1-propyltridecyl 3-phenylpropanoate CAS Name: 3-phenylpropanoic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl 3-phenylpropanoate Traditional Name: 3-phenylpropionic acid 1-propyltridecyl ester Formula: C25H42O2 MolecularWeight: 374.59978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)CCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)CCC1=CC=CC=C1

InChI

InChI=1S/C25H42O2/c1-3-5-6-7-8-9-10-11-12-16-20-24(17-4-2)27-25(26)22-21-23-18-14-13-15-19-23/h13-15,18-19,24H,3-12,16-17,20-22H2,1-2H3