(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate

Systemtic Name: (1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Openeye Name: (1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate CAS Name: 4-(1-dodecoxyethyl)benzoic acid (1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Traditional Name: 4-(1-lauryloxyethyl)benzoic acid (1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C38H54O3 MolecularWeight: 558.83356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)CCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)CCCCC

InChI

InChI=1S/C38H54O3/c1-4-6-8-9-10-11-12-13-14-19-31-40-32(3)33-22-24-36(25-23-33)37(39)41-38(28-18-7-5-2)29-26-35(27-30-38)34-20-16-15-17-21-34/h15-17,20-27,29-30,32,35H,4-14,18-19,28,31H2,1-3H3