3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(3-imidazol-1-ylpropyl)-4-oxidanylidene-pyridin-2-olate

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-(3-imidazol-1-ylpropyl)-4-oxidanylidene-pyridin-2-olate Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl]-1-(3-imidazol-1-ylpropyl)-4-oxo-pyridin-2-olate CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-1-[3-(1-imidazolyl)propyl]-4-oxo-2-pyridinolate IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-1-(3-imidazol-1-ylpropyl)-4-oxopyridin-2-olate Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-1-(3-imidazol-1-ylpropyl)-4-keto-pyridin-2-olate Formula: C18H16ClFN3O2- MolecularWeight: 360.789943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=C(N(C=CC2=O)CCCN3C=CN=C3)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=C(N(C=CC2=O)CCCN3C=CN=C3)[O-])F

InChI

InChI=1S/C18H17ClFN3O2/c19-15-3-1-4-16(20)13(15)11-14-17(24)5-9-23(18(14)25)8-2-7-22-10-6-21-12-22/h1,3-6,9-10,12,25H,2,7-8,11H2/p-1