[5,6-bis(chloranyl)pyridin-3-yl] 4-(4-octylphenyl)benzoate

Systemtic Name: [5,6-bis(chloranyl)pyridin-3-yl] 4-(4-octylphenyl)benzoate Openeye Name: (5,6-dichloro-3-pyridyl) 4-(4-octylphenyl)benzoate CAS Name: 4-(4-octylphenyl)benzoic acid (5,6-dichloro-3-pyridinyl) ester IUPAC Name: (5,6-dichloropyridin-3-yl) 4-(4-octylphenyl)benzoate Traditional Name: 4-(4-octylphenyl)benzoic acid (5,6-dichloro-3-pyridyl) ester Formula: C26H27Cl2NO2 MolecularWeight: 456.40408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(N=C3)Cl)Cl

InChI

InChI=1S/C26H27Cl2NO2/c1-2-3-4-5-6-7-8-19-9-11-20(12-10-19)21-13-15-22(16-14-21)26(30)31-23-17-24(27)25(28)29-18-23/h9-18H,2-8H2,1H3