[(S)-(3-fluoranyl-4-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]azanium

Systemtic Name: [(S)-(3-fluoranyl-4-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [(S)-(3-fluoro-4-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [(S)-(3-fluoro-4-methylphenyl)-(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(S)-(3-fluoro-4-methylphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [(S)-(3-fluoro-4-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]ammonium Formula: C12H15FN3+ MolecularWeight: 220.266003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C2=CN(N=C2)C)[NH3+])F

Isomeric SMILES

CC1=C(C=C(C=C1)[C@@H](C2=CN(N=C2)C)[NH3+])F

InChI

InChI=1S/C12H14FN3/c1-8-3-4-9(5-11(8)13)12(14)10-6-15-16(2)7-10/h3-7,12H,14H2,1-2H3/p+1/t12-/m0/s1