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

Systemtic Name: (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Openeye Name: (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate CAS Name: 4-(1-dodecoxyethyl)benzoic acid (4-phenyl-1-propyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (4-phenyl-1-propylcyclohexa-2,5-dien-1-yl) 4-(1-dodecoxyethyl)benzoate Traditional Name: 4-(1-lauryloxyethyl)benzoic acid (4-phenyl-1-propyl-cyclohexa-2,5-dien-1-yl) ester Formula: C36H50O3 MolecularWeight: 530.7804

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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)CCC

Isomeric SMILES

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

InChI

InChI=1S/C36H50O3/c1-4-6-7-8-9-10-11-12-13-17-29-38-30(3)31-20-22-34(23-21-31)35(37)39-36(26-5-2)27-24-33(25-28-36)32-18-15-14-16-19-32/h14-16,18-25,27-28,30,33H,4-13,17,26,29H2,1-3H3