(1-dodecoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-octadecoxyethyl)benzoate

Systemtic Name: (1-dodecoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-octadecoxyethyl)benzoate Openeye Name: (1-dodecoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-octadecoxyethyl)benzoate CAS Name: 4-(1-octadecoxyethyl)benzoic acid (1-dodecoxy-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-dodecoxy-4-phenylcyclohexa-2,5-dien-1-yl) 4-(1-octadecoxyethyl)benzoate Traditional Name: 4-(1-stearyloxyethyl)benzoic acid (1-lauryloxy-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C51H80O4 MolecularWeight: 757.1785

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C)C1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)OCCCCCCCCCCCC

InChI

InChI=1S/C51H80O4/c1-4-6-8-10-12-14-16-17-18-19-20-21-22-24-26-31-43-53-45(3)46-35-37-49(38-36-46)50(52)55-51(41-39-48(40-42-51)47-33-29-28-30-34-47)54-44-32-27-25-23-15-13-11-9-7-5-2/h28-30,33-42,45,48H,4-27,31-32,43-44H2,1-3H3