hexadecan-7-yl benzoate

Systemtic Name: hexadecan-7-yl benzoate Openeye Name: 1-hexyldecyl benzoate CAS Name: benzoic acid hexadecan-7-yl ester IUPAC Name: hexadecan-7-yl benzoate Traditional Name: benzoic acid 1-hexyldecyl ester Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCC(CCCCCC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C23H38O2/c1-3-5-7-9-10-11-16-20-22(19-15-8-6-4-2)25-23(24)21-17-13-12-14-18-21/h12-14,17-18,22H,3-11,15-16,19-20H2,1-2H3