sodium 4-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: sodium 4-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-4-oxidanylidene-butanoate Openeye Name: sodium 4-[[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]-4-oxo-butanoate CAS Name: sodium 4-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-4-oxobutanoate IUPAC Name: sodium 4-[[5-(4-fluorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]amino]-4-oxobutanoate Traditional Name: sodium 4-[[5-(4-fluorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]amino]-4-keto-butyrate Formula: C18H14FN4NaO3 MolecularWeight: 376.316933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(C(=NN2)NC(=O)CCC(=O)[O-])C3=CC=NC=C3)F.[Na+]

Isomeric SMILES

C1=CC(=CC=C1C2=C(C(=NN2)NC(=O)CCC(=O)[O-])C3=CC=NC=C3)F.[Na+]

InChI

InChI=1S/C18H15FN4O3.Na/c19-13-3-1-12(2-4-13)17-16(11-7-9-20-10-8-11)18(23-22-17)21-14(24)5-6-15(25)26;/h1-4,7-10H,5-6H2,(H,25,26)(H2,21,22,23,24);/q;+1/p-1