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

Systemtic Name: [5,6-bis(chloranyl)pyridin-3-yl] 4-(4-propylphenyl)benzoate Openeye Name: (5,6-dichloro-3-pyridyl) 4-(4-propylphenyl)benzoate CAS Name: 4-(4-propylphenyl)benzoic acid (5,6-dichloro-3-pyridinyl) ester IUPAC Name: (5,6-dichloropyridin-3-yl) 4-(4-propylphenyl)benzoate Traditional Name: 4-(4-propylphenyl)benzoic acid (5,6-dichloro-3-pyridyl) ester Formula: C21H17Cl2NO2 MolecularWeight: 386.27118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(N=C3)Cl)Cl

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC(=C(N=C3)Cl)Cl

InChI

InChI=1S/C21H17Cl2NO2/c1-2-3-14-4-6-15(7-5-14)16-8-10-17(11-9-16)21(25)26-18-12-19(22)20(23)24-13-18/h4-13H,2-3H2,1H3