[(1S,2S,3S)-2,3-dimethylcyclohexyl]-heptan-4-yl-azanium

Systemtic Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-heptan-4-yl-azanium Openeye Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-(1-propylbutyl)ammonium CAS Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-heptan-4-ylammonium IUPAC Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-heptan-4-ylazanium Traditional Name: [(1S,2S,3S)-2,3-dimethylcyclohexyl]-(1-propylbutyl)ammonium Formula: C15H32N+ MolecularWeight: 226.42128

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]C1CCCC(C1C)C

Isomeric SMILES

CCCC(CCC)[NH2+][C@H]1CCC[C@@H]([C@@H]1C)C

InChI

InChI=1S/C15H31N/c1-5-8-14(9-6-2)16-15-11-7-10-12(3)13(15)4/h12-16H,5-11H2,1-4H3/p+1/t12-,13-,15-/m0/s1