[1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-hexoxybenzoate

Systemtic Name: [1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-hexoxybenzoate Openeye Name: [1-(1-dodecoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-hexoxybenzoate CAS Name: 4-hexoxybenzoic acid [1-(1-dodecoxyethyl)-4-phenyl-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [1-(1-dodecoxyethyl)-4-phenylcyclohexa-2,5-dien-1-yl] 4-hexoxybenzoate Traditional Name: 4-hexoxybenzoic acid [1-(1-lauryloxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] ester Formula: C39H56O4 MolecularWeight: 588.85954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3=CC=C(C=C3)OCCCCCC

InChI

InChI=1S/C39H56O4/c1-4-6-8-10-11-12-13-14-15-20-31-41-33(3)39(29-27-35(28-30-39)34-21-17-16-18-22-34)43-38(40)36-23-25-37(26-24-36)42-32-19-9-7-5-2/h16-18,21-30,33,35H,4-15,19-20,31-32H2,1-3H3