[4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium

Systemtic Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-azanium Openeye Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-ammonium CAS Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)-3-pyrazolyl]methyl-(1H-imidazol-2-ylmethyl)-methylammonium IUPAC Name: [4-ethoxycarbonyl-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(1H-imidazol-2-ylmethyl)-methylazanium Traditional Name: [4-carbethoxy-2-(3-fluorophenyl)pyrazol-3-yl]methyl-(1H-imidazol-2-ylmethyl)-methyl-ammonium Formula: C18H21FN5O2+ MolecularWeight: 358.390043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)C[NH+](C)CC3=NC=CN3

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC(=CC=C2)F)C[NH+](C)CC3=NC=CN3

InChI

InChI=1S/C18H20FN5O2/c1-3-26-18(25)15-10-22-24(14-6-4-5-13(19)9-14)16(15)11-23(2)12-17-20-7-8-21-17/h4-10H,3,11-12H2,1-2H3,(H,20,21)/p+1