1-[2-ethyl-5-(4-fluorophenyl)-1-methyl-pyrazol-3-ylidene]piperidin-1-ium

Systemtic Name: 1-[2-ethyl-5-(4-fluorophenyl)-1-methyl-pyrazol-3-ylidene]piperidin-1-ium Openeye Name: 1-[2-ethyl-5-(4-fluorophenyl)-1-methyl-pyrazol-3-ylidene]piperidin-1-ium CAS Name: 1-[2-ethyl-5-(4-fluorophenyl)-1-methyl-3-pyrazolylidene]piperidin-1-ium IUPAC Name: 1-[2-ethyl-5-(4-fluorophenyl)-1-methylpyrazol-3-ylidene]piperidin-1-ium Traditional Name: 1-[2-ethyl-5-(4-fluorophenyl)-1-methyl-3-pyrazolin-3-ylidene]piperidin-1-ium Formula: C17H23FN3+ MolecularWeight: 288.383023

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=[N+]2CCCCC2)C=C(N1C)C3=CC=C(C=C3)F

Isomeric SMILES

CCN1C(=[N+]2CCCCC2)C=C(N1C)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H23FN3/c1-3-21-17(20-11-5-4-6-12-20)13-16(19(21)2)14-7-9-15(18)10-8-14/h7-10,13H,3-6,11-12H2,1-2H3/q+1