hexadecan-4-yl 2-phenylethanoate

Systemtic Name: hexadecan-4-yl 2-phenylethanoate Openeye Name: 1-propyltridecyl 2-phenylacetate CAS Name: 2-phenylacetic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl 2-phenylacetate Traditional Name: 2-phenylacetic acid 1-propyltridecyl ester Formula: C24H40O2 MolecularWeight: 360.5732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)CC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)CC1=CC=CC=C1

InChI

InChI=1S/C24H40O2/c1-3-5-6-7-8-9-10-11-12-16-20-23(17-4-2)26-24(25)21-22-18-14-13-15-19-22/h13-15,18-19,23H,3-12,16-17,20-21H2,1-2H3