tetradecan-5-yl 4-methylbenzoate

Systemtic Name: tetradecan-5-yl 4-methylbenzoate Openeye Name: 1-butyldecyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid tetradecan-5-yl ester IUPAC Name: tetradecan-5-yl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 1-butyldecyl ester Formula: C22H36O2 MolecularWeight: 332.52004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCC)OC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCCCCCCCCC(CCCC)OC(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C22H36O2/c1-4-6-8-9-10-11-12-14-21(13-7-5-2)24-22(23)20-17-15-19(3)16-18-20/h15-18,21H,4-14H2,1-3H3