(3-fluoranyl-4-phenyl-phenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: (3-fluoranyl-4-phenyl-phenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Openeye Name: (3-fluoro-4-phenyl-phenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: (3-fluoro-4-phenylphenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: (3-fluoro-4-phenylphenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Traditional Name: (3-fluoro-4-phenyl-phenyl)-[(3S)-1-[(5-methyl-1H-pyrazol-3-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C23H25FN3O+ MolecularWeight: 378.462503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)C[NH+]2CCCC(C2)C(=O)C3=CC(=C(C=C3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=CC(=NN1)C[NH+]2CCC[C@@H](C2)C(=O)C3=CC(=C(C=C3)C4=CC=CC=C4)F

InChI

InChI=1S/C23H24FN3O/c1-16-12-20(26-25-16)15-27-11-5-8-19(14-27)23(28)18-9-10-21(22(24)13-18)17-6-3-2-4-7-17/h2-4,6-7,9-10,12-13,19H,5,8,11,14-15H2,1H3,(H,25,26)/p+1/t19-/m0/s1