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

Systemtic Name: [(S)-(3-methoxyphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Openeye Name: [(S)-(3-methoxyphenyl)-(1-methylpyrazol-4-yl)methyl]ammonium CAS Name: [(S)-(3-methoxyphenyl)-(1-methyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [(S)-(3-methoxyphenyl)-(1-methylpyrazol-4-yl)methyl]azanium Traditional Name: [(S)-(3-methoxyphenyl)-(1-methylpyrazol-4-yl)methyl]ammonium Formula: C12H16N3O+ MolecularWeight: 218.27494

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C(C2=CC(=CC=C2)OC)[NH3+]

Isomeric SMILES

CN1C=C(C=N1)[C@H](C2=CC(=CC=C2)OC)[NH3+]

InChI

InChI=1S/C12H15N3O/c1-15-8-10(7-14-15)12(13)9-4-3-5-11(6-9)16-2/h3-8,12H,13H2,1-2H3/p+1/t12-/m0/s1