[(1R,3S)-1-(azaniumylmethyl)-3-methyl-cyclohexyl]-dibutyl-azanium

Systemtic Name: [(1R,3S)-1-(azaniumylmethyl)-3-methyl-cyclohexyl]-dibutyl-azanium Openeye Name: [(1R,3S)-1-(azaniumylmethyl)-3-methyl-cyclohexyl]-dibutyl-ammonium CAS Name: [(1R,3S)-1-(ammoniomethyl)-3-methylcyclohexyl]-dibutylammonium IUPAC Name: [(1R,3S)-1-(azaniumylmethyl)-3-methylcyclohexyl]-dibutylazanium Traditional Name: [(1R,3S)-1-(ammoniomethyl)-3-methyl-cyclohexyl]-dibutyl-ammonium Formula: C16H36N2+2 MolecularWeight: 256.47044

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)C1(CCCC(C1)C)C[NH3+]

Isomeric SMILES

CCCC[NH+](CCCC)[C@@]1(CCC[C@@H](C1)C)C[NH3+]

InChI

InChI=1S/C16H34N2/c1-4-6-11-18(12-7-5-2)16(14-17)10-8-9-15(3)13-16/h15H,4-14,17H2,1-3H3/p+2/t15-,16+/m0/s1