(1-phenyl-4-bicyclo[2.2.2]octanyl) 4-pentoxybenzoate

Systemtic Name: (1-phenyl-4-bicyclo[2.2.2]octanyl) 4-pentoxybenzoate Openeye Name: (1-phenyl-4-bicyclo[2.2.2]octanyl) 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid (1-phenyl-4-bicyclo[2.2.2]octanyl) ester IUPAC Name: (1-phenyl-4-bicyclo[2.2.2]octanyl) 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid (1-phenyl-4-bicyclo[2.2.2]octanyl) ester Formula: C26H32O3 MolecularWeight: 392.53048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OC23CCC(CC2)(CC3)C4=CC=CC=C4

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OC23CCC(CC2)(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H32O3/c1-2-3-7-20-28-23-12-10-21(11-13-23)24(27)29-26-17-14-25(15-18-26,16-19-26)22-8-5-4-6-9-22/h4-6,8-13H,2-3,7,14-20H2,1H3