3-[[(2S,6S)-2,6-dimethylcyclohexyl]azaniumyl]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(2S,6S)-2,6-dimethylcyclohexyl]azaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(2S,6S)-2,6-dimethylcyclohexyl]ammonio]propyl]-methyl-ammonium CAS Name: 3-[[(2S,6S)-2,6-dimethylcyclohexyl]ammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(2S,6S)-2,6-dimethylcyclohexyl]azaniumyl]propyl]-methylazanium Traditional Name: benzyl-[3-[[(2S,6S)-2,6-dimethylcyclohexyl]ammonio]propyl]-methyl-ammonium Formula: C19H34N2+2 MolecularWeight: 290.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1[NH2+]CCC[NH+](C)CC2=CC=CC=C2)C

Isomeric SMILES

C[C@H]1CCC[C@@H](C1[NH2+]CCC[NH+](C)CC2=CC=CC=C2)C

InChI

InChI=1S/C19H32N2/c1-16-9-7-10-17(2)19(16)20-13-8-14-21(3)15-18-11-5-4-6-12-18/h4-6,11-12,16-17,19-20H,7-10,13-15H2,1-3H3/p+2/t16-,17-/m0/s1