hexadecan-4-yl pentanoate

Systemtic Name: hexadecan-4-yl pentanoate Openeye Name: 1-propyltridecyl pentanoate CAS Name: pentanoic acid hexadecan-4-yl ester IUPAC Name: hexadecan-4-yl pentanoate Traditional Name: valeric acid 1-propyltridecyl ester Formula: C21H42O2 MolecularWeight: 326.55698

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCC)OC(=O)CCCC

Isomeric SMILES

CCCCCCCCCCCCC(CCC)OC(=O)CCCC

InChI

InChI=1S/C21H42O2/c1-4-7-9-10-11-12-13-14-15-16-18-20(17-6-3)23-21(22)19-8-5-2/h20H,4-19H2,1-3H3