(1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 2,2-dimethylcyclopropane-1-carboxylate

Systemtic Name: (1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 2,2-dimethylcyclopropane-1-carboxylate Openeye Name: (1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) 2,2-dimethylcyclopropanecarboxylate CAS Name: 2,2-dimethyl-1-cyclopropanecarboxylic acid (1-octoxy-4-phenyl-1-cyclohexa-2,5-dienyl) ester IUPAC Name: (1-octoxy-4-phenylcyclohexa-2,5-dien-1-yl) 2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 2,2-dimethylcyclopropanecarboxylic acid (1-octoxy-4-phenyl-cyclohexa-2,5-dien-1-yl) ester Formula: C26H36O3 MolecularWeight: 396.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3CC3(C)C

Isomeric SMILES

CCCCCCCCOC1(C=CC(C=C1)C2=CC=CC=C2)OC(=O)C3CC3(C)C

InChI

InChI=1S/C26H36O3/c1-4-5-6-7-8-12-19-28-26(29-24(27)23-20-25(23,2)3)17-15-22(16-18-26)21-13-10-9-11-14-21/h9-11,13-18,22-23H,4-8,12,19-20H2,1-3H3