[(1S)-1-(1-benzofuran-2-yl)-2-(3,5-dimethylpyrazol-1-yl)ethyl]azanium

Systemtic Name: [(1S)-1-(1-benzofuran-2-yl)-2-(3,5-dimethylpyrazol-1-yl)ethyl]azanium Openeye Name: [(1S)-1-(benzofuran-2-yl)-2-(3,5-dimethylpyrazol-1-yl)ethyl]ammonium CAS Name: [(1S)-1-(2-benzofuranyl)-2-(3,5-dimethyl-1-pyrazolyl)ethyl]ammonium IUPAC Name: [(1S)-1-(1-benzofuran-2-yl)-2-(3,5-dimethylpyrazol-1-yl)ethyl]azanium Traditional Name: [(1S)-1-(benzofuran-2-yl)-2-(3,5-dimethylpyrazol-1-yl)ethyl]ammonium Formula: C15H18N3O+ MolecularWeight: 256.32292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CC(C2=CC3=CC=CC=C3O2)[NH3+])C

Isomeric SMILES

CC1=CC(=NN1C[C@@H](C2=CC3=CC=CC=C3O2)[NH3+])C

InChI

InChI=1S/C15H17N3O/c1-10-7-11(2)18(17-10)9-13(16)15-8-12-5-3-4-6-14(12)19-15/h3-8,13H,9,16H2,1-2H3/p+1/t13-/m0/s1