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

Systemtic Name: (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Openeye Name: (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate CAS Name: 4-(1-dodecoxyethyl)benzoic acid (1-butyl-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-butyl-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Traditional Name: 4-(1-lauryloxyethyl)benzoic acid (1-butyl-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C37H52O3 MolecularWeight: 544.80698

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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)CCCC

Isomeric SMILES

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

InChI

InChI=1S/C37H52O3/c1-4-6-8-9-10-11-12-13-14-18-30-39-31(3)32-21-23-35(24-22-32)36(38)40-37(27-7-5-2)28-25-34(26-29-37)33-19-16-15-17-20-33/h15-17,19-26,28-29,31,34H,4-14,18,27,30H2,1-3H3