[(2R)-2-[(3S)-3-methylpiperidin-1-yl]-2-(1-phenylpyrazol-4-yl)ethyl]azanium

Systemtic Name: [(2R)-2-[(3S)-3-methylpiperidin-1-yl]-2-(1-phenylpyrazol-4-yl)ethyl]azanium Openeye Name: [(2R)-2-[(3S)-3-methyl-1-piperidyl]-2-(1-phenylpyrazol-4-yl)ethyl]ammonium CAS Name: [(2R)-2-[(3S)-3-methyl-1-piperidinyl]-2-(1-phenyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: [(2R)-2-[(3S)-3-methylpiperidin-1-yl]-2-(1-phenylpyrazol-4-yl)ethyl]azanium Traditional Name: [(2R)-2-[(3S)-3-methylpiperidino]-2-(1-phenylpyrazol-4-yl)ethyl]ammonium Formula: C17H25N4+ MolecularWeight: 285.4072

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(C[NH3+])C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C[C@H]1CCCN(C1)[C@@H](C[NH3+])C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C17H24N4/c1-14-6-5-9-20(12-14)17(10-18)15-11-19-21(13-15)16-7-3-2-4-8-16/h2-4,7-8,11,13-14,17H,5-6,9-10,12,18H2,1H3/p+1/t14-,17-/m0/s1