[3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1S)-1-pyridin-3-ylethyl]azanium

Systemtic Name: [3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1S)-1-pyridin-3-ylethyl]azanium Openeye Name: [3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1S)-1-(3-pyridyl)ethyl]ammonium CAS Name: [3-(4-fluorophenyl)-1-phenyl-4-pyrazolyl]methyl-[(1S)-1-(3-pyridinyl)ethyl]ammonium IUPAC Name: [3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methyl-[(1S)-1-pyridin-3-ylethyl]azanium Traditional Name: [3-(4-fluorophenyl)-1-phenyl-pyrazol-4-yl]methyl-[(1S)-1-(3-pyridyl)ethyl]ammonium Formula: C23H22FN4+ MolecularWeight: 373.445983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)[NH2+]CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

C[C@@H](C1=CN=CC=C1)[NH2+]CC2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C23H21FN4/c1-17(19-6-5-13-25-14-19)26-15-20-16-28(22-7-3-2-4-8-22)27-23(20)18-9-11-21(24)12-10-18/h2-14,16-17,26H,15H2,1H3/p+1/t17-/m0/s1