[4-(4-tetradecoxyphenyl)phenyl] 2-methylpentanoate

Systemtic Name: [4-(4-tetradecoxyphenyl)phenyl] 2-methylpentanoate Openeye Name: [4-(4-tetradecoxyphenyl)phenyl] 2-methylpentanoate CAS Name: 2-methylpentanoic acid [4-(4-tetradecoxyphenyl)phenyl] ester IUPAC Name: [4-(4-tetradecoxyphenyl)phenyl] 2-methylpentanoate Traditional Name: 2-methylvaleric acid [4-(4-myristyloxyphenyl)phenyl] ester Formula: C32H48O3 MolecularWeight: 480.72172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CCC

Isomeric SMILES

CCCCCCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C(C)CCC

InChI

InChI=1S/C32H48O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-26-34-30-22-18-28(19-23-30)29-20-24-31(25-21-29)35-32(33)27(3)17-5-2/h18-25,27H,4-17,26H2,1-3H3