(3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium

Systemtic Name: (3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Openeye Name: (3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium CAS Name: (3S)-1-[[(1R)-1-cyclohex-3-enyl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium IUPAC Name: (3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Traditional Name: (3S)-1-[[(1R)-cyclohex-3-en-1-yl]methyl]-3-(4-ethyl-1H-pyrazol-5-yl)piperidin-1-ium Formula: C17H28N3+ MolecularWeight: 274.42432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NN=C1)C2CCC[NH+](C2)CC3CCC=CC3

Isomeric SMILES

CCC1=C(NN=C1)[C@H]2CCC[NH+](C2)C[C@@H]3CCC=CC3

InChI

InChI=1S/C17H27N3/c1-2-15-11-18-19-17(15)16-9-6-10-20(13-16)12-14-7-4-3-5-8-14/h3-4,11,14,16H,2,5-10,12-13H2,1H3,(H,18,19)/p+1/t14-,16-/m0/s1