(3S)-1-(cyclohexylmethyl)-3-(4-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-ium

Systemtic Name: (3S)-1-(cyclohexylmethyl)-3-(4-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-ium Openeye Name: (3S)-1-(cyclohexylmethyl)-3-(4-isopropyl-1H-pyrazol-5-yl)piperidin-1-ium CAS Name: (3S)-1-(cyclohexylmethyl)-3-(4-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-ium IUPAC Name: (3S)-1-(cyclohexylmethyl)-3-(4-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-ium Traditional Name: (3S)-1-(cyclohexylmethyl)-3-(4-isopropyl-1H-pyrazol-5-yl)piperidin-1-ium Formula: C18H32N3+ MolecularWeight: 290.46678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(NN=C1)C2CCC[NH+](C2)CC3CCCCC3

Isomeric SMILES

CC(C)C1=C(NN=C1)[C@H]2CCC[NH+](C2)CC3CCCCC3

InChI

InChI=1S/C18H31N3/c1-14(2)17-11-19-20-18(17)16-9-6-10-21(13-16)12-15-7-4-3-5-8-15/h11,14-16H,3-10,12-13H2,1-2H3,(H,19,20)/p+1/t16-/m0/s1