[(1S,2S,4S)-4-(2-methylbutan-2-yl)-2-pyrazol-1-yl-cyclohexyl]azanium

Systemtic Name: [(1S,2S,4S)-4-(2-methylbutan-2-yl)-2-pyrazol-1-yl-cyclohexyl]azanium Openeye Name: [(1S,2S,4S)-4-(1,1-dimethylpropyl)-2-pyrazol-1-yl-cyclohexyl]ammonium CAS Name: [(1S,2S,4S)-4-(2-methylbutan-2-yl)-2-(1-pyrazolyl)cyclohexyl]ammonium IUPAC Name: [(1S,2S,4S)-4-(2-methylbutan-2-yl)-2-pyrazol-1-ylcyclohexyl]azanium Traditional Name: [(1S,2S,4S)-4-tert-amyl-2-pyrazol-1-yl-cyclohexyl]ammonium Formula: C14H26N3+ MolecularWeight: 236.37634

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC(C(C1)N2C=CC=N2)[NH3+]

Isomeric SMILES

CCC(C)(C)[C@H]1CC[C@@H]([C@H](C1)N2C=CC=N2)[NH3+]

InChI

InChI=1S/C14H25N3/c1-4-14(2,3)11-6-7-12(15)13(10-11)17-9-5-8-16-17/h5,8-9,11-13H,4,6-7,10,15H2,1-3H3/p+1/t11-,12-,13-/m0/s1