[4-(aminomethyl)-3-chloranyl-2-methyl-2-phenyl-3H-pyrazol-2-ium-4-yl]-(2-fluorophenyl)methanone

Systemtic Name: [4-(aminomethyl)-3-chloranyl-2-methyl-2-phenyl-3H-pyrazol-2-ium-4-yl]-(2-fluorophenyl)methanone Openeye Name: [4-(aminomethyl)-3-chloro-2-methyl-2-phenyl-3H-pyrazol-2-ium-4-yl]-(2-fluorophenyl)methanone CAS Name: [4-(aminomethyl)-3-chloro-2-methyl-2-phenyl-3H-pyrazol-2-ium-4-yl]-(2-fluorophenyl)methanone IUPAC Name: [4-(aminomethyl)-3-chloro-2-methyl-2-phenyl-3H-pyrazol-2-ium-4-yl]-(2-fluorophenyl)methanone Traditional Name: [4-(aminomethyl)-5-chloro-1-methyl-1-phenyl-2-pyrazolin-1-ium-4-yl]-(2-fluorophenyl)methanone Formula: C18H18ClFN3O+ MolecularWeight: 346.806423

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C(C(C=N1)(CN)C(=O)C2=CC=CC=C2F)Cl)C3=CC=CC=C3

Isomeric SMILES

C[N+]1(C(C(C=N1)(CN)C(=O)C2=CC=CC=C2F)Cl)C3=CC=CC=C3

InChI

InChI=1S/C18H18ClFN3O/c1-23(13-7-3-2-4-8-13)17(19)18(11-21,12-22-23)16(24)14-9-5-6-10-15(14)20/h2-10,12,17H,11,21H2,1H3/q+1