(3-fluorophenyl)methyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-azanium

Systemtic Name: (3-fluorophenyl)methyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-azanium Openeye Name: (3-fluorophenyl)methyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methyl-ammonium CAS Name: (3-fluorophenyl)methyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methylammonium IUPAC Name: (3-fluorophenyl)methyl-[4-(hydroxymethyl)-2,5-dimethyl-1H-pyrazol-3-ylidene]-methylazanium Traditional Name: (2,5-dimethyl-4-methylol-3-pyrazolin-3-ylidene)-(3-fluorobenzyl)-methyl-ammonium Formula: C14H19FN3O+ MolecularWeight: 264.318563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[N+](C)CC2=CC(=CC=C2)F)N(N1)C)CO

Isomeric SMILES

CC1=C(C(=[N+](C)CC2=CC(=CC=C2)F)N(N1)C)CO

InChI

InChI=1S/C14H18FN3O/c1-10-13(9-19)14(18(3)16-10)17(2)8-11-5-4-6-12(15)7-11/h4-7,19H,8-9H2,1-3H3/p+1