[(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3-methoxyphenyl)ethyl]azanium

Systemtic Name: [(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3-methoxyphenyl)ethyl]azanium Openeye Name: [(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3-methoxyphenyl)ethyl]ammonium CAS Name: [(2S)-2-(1,3-dimethyl-4-pyrazolyl)-2-(3-methoxyphenyl)ethyl]ammonium IUPAC Name: [(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3-methoxyphenyl)ethyl]azanium Traditional Name: [(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3-methoxyphenyl)ethyl]ammonium Formula: C14H20N3O+ MolecularWeight: 246.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(C[NH3+])C2=CC(=CC=C2)OC)C

Isomeric SMILES

CC1=NN(C=C1[C@@H](C[NH3+])C2=CC(=CC=C2)OC)C

InChI

InChI=1S/C14H19N3O/c1-10-14(9-17(2)16-10)13(8-15)11-5-4-6-12(7-11)18-3/h4-7,9,13H,8,15H2,1-3H3/p+1/t13-/m0/s1