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

Systemtic Name: (1-dodecoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-nonadecoxyethyl)benzoate Openeye Name: (1-dodecoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 4-(1-nonadecoxyethyl)benzoate CAS Name: 4-(1-nonadecoxyethyl)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-nonadecoxyethyl)benzoate Traditional Name: 4-(1-nonadecoxyethyl)benzoic acid (1-lauryloxy-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C52H82O4 MolecularWeight: 771.20508

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C52H82O4/c1-4-6-8-10-12-14-16-17-18-19-20-21-22-23-25-27-32-44-54-46(3)47-36-38-50(39-37-47)51(53)56-52(42-40-49(41-43-52)48-34-30-29-31-35-48)55-45-33-28-26-24-15-13-11-9-7-5-2/h29-31,34-43,46,49H,4-28,32-33,44-45H2,1-3H3