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

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-4-oxidanylidene-1-[2-(4-sulfamoylphenyl)ethyl]pyridin-2-olate Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methyl]-4-oxo-1-[2-(4-sulfamoylphenyl)ethyl]pyridin-2-olate CAS Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-1-[2-(4-sulfamoylphenyl)ethyl]-2-pyridinolate IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methyl]-4-oxo-1-[2-(4-sulfamoylphenyl)ethyl]pyridin-2-olate Traditional Name: 3-(2-chloro-6-fluoro-benzyl)-4-keto-1-[2-(4-sulfamoylphenyl)ethyl]pyridin-2-olate Formula: C20H17ClFN2O4S- MolecularWeight: 435.876383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=C(N(C=CC2=O)CCC3=CC=C(C=C3)S(=O)(=O)N)[O-])F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=C(N(C=CC2=O)CCC3=CC=C(C=C3)S(=O)(=O)N)[O-])F

InChI

InChI=1S/C20H18ClFN2O4S/c21-17-2-1-3-18(22)15(17)12-16-19(25)9-11-24(20(16)26)10-8-13-4-6-14(7-5-13)29(23,27)28/h1-7,9,11,26H,8,10,12H2,(H2,23,27,28)/p-1