(2-octoxyphenyl) 4-pyridin-2-ylbenzoate

Systemtic Name: (2-octoxyphenyl) 4-pyridin-2-ylbenzoate Openeye Name: (2-octoxyphenyl) 4-(2-pyridyl)benzoate CAS Name: 4-(2-pyridinyl)benzoic acid (2-octoxyphenyl) ester IUPAC Name: (2-octoxyphenyl) 4-pyridin-2-ylbenzoate Traditional Name: 4-(2-pyridyl)benzoic acid (2-octoxyphenyl) ester Formula: C26H29NO3 MolecularWeight: 403.51336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

CCCCCCCCOC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C26H29NO3/c1-2-3-4-5-6-11-20-29-24-13-7-8-14-25(24)30-26(28)22-17-15-21(16-18-22)23-12-9-10-19-27-23/h7-10,12-19H,2-6,11,20H2,1H3