1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-oxidanylidene-pyridin-2-olate

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-oxidanylidene-pyridin-2-olate Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chloro-6-fluoro-phenyl)methyl]-4-oxo-pyridin-2-olate CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-2-pyridinolate IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[(2-chloro-6-fluorophenyl)methyl]-4-oxopyridin-2-olate Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-4-keto-1-piperonyl-pyridin-2-olate Formula: C20H14ClFNO4- MolecularWeight: 386.780863

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C=CC(=O)C(=C3[O-])CC4=C(C=CC=C4Cl)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C=CC(=O)C(=C3[O-])CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C20H15ClFNO4/c21-15-2-1-3-16(22)13(15)9-14-17(24)6-7-23(20(14)25)10-12-4-5-18-19(8-12)27-11-26-18/h1-8,25H,9-11H2/p-1