(4-propan-2-ylphenyl) octadecanoate

Systemtic Name: (4-propan-2-ylphenyl) octadecanoate Openeye Name: (4-isopropylphenyl) octadecanoate CAS Name: octadecanoic acid (4-propan-2-ylphenyl) ester IUPAC Name: (4-propan-2-ylphenyl) octadecanoate Traditional Name: stearic acid p-cumenyl ester Formula: C27H46O2 MolecularWeight: 402.65294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC1=CC=C(C=C1)C(C)C

InChI

InChI=1S/C27H46O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-27(28)29-26-22-20-25(21-23-26)24(2)3/h20-24H,4-19H2,1-3H3