[(1S)-1-[1-(3-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]-phenethyl-azanium

Systemtic Name: [(1S)-1-[1-(3-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]-phenethyl-azanium Openeye Name: [(1S)-1-[1-(3-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]-phenethyl-ammonium CAS Name: [(1S)-1-[1-(3-fluorophenyl)-5-methyl-4-pyrazolyl]ethyl]-phenethylammonium IUPAC Name: [(1S)-1-[1-(3-fluorophenyl)-5-methylpyrazol-4-yl]ethyl]-phenethylazanium Traditional Name: [(1S)-1-[1-(3-fluorophenyl)-5-methyl-pyrazol-4-yl]ethyl]-phenethyl-ammonium Formula: C20H23FN3+ MolecularWeight: 324.415123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC(=CC=C2)F)C(C)[NH2+]CCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C2=CC(=CC=C2)F)[C@H](C)[NH2+]CCC3=CC=CC=C3

InChI

InChI=1S/C20H22FN3/c1-15(22-12-11-17-7-4-3-5-8-17)20-14-23-24(16(20)2)19-10-6-9-18(21)13-19/h3-10,13-15,22H,11-12H2,1-2H3/p+1/t15-/m0/s1