[4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(pyridin-2-ylmethyl)azanium

Systemtic Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(pyridin-2-ylmethyl)azanium Openeye Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(2-pyridylmethyl)ammonium CAS Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)-3-pyrazolyl]methyl-(2-pyridinylmethyl)ammonium IUPAC Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(pyridin-2-ylmethyl)azanium Traditional Name: [4-carbethoxy-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(2-pyridylmethyl)ammonium Formula: C19H20FN4O2+ MolecularWeight: 355.386103

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)C[NH2+]CC3=CC=CC=N3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)C[NH2+]CC3=CC=CC=N3

InChI

InChI=1S/C19H19FN4O2/c1-2-26-19(25)17-12-23-24(16-8-5-6-14(20)10-16)18(17)13-21-11-15-7-3-4-9-22-15/h3-10,12,21H,2,11,13H2,1H3/p+1