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

Systemtic Name: [(1R,3S)-1-(azaniumylmethyl)-3-methyl-cyclohexyl]-methyl-(phenylmethyl)azanium Openeye Name: [(1R,3S)-1-(azaniumylmethyl)-3-methyl-cyclohexyl]-benzyl-methyl-ammonium CAS Name: [(1R,3S)-1-(ammoniomethyl)-3-methylcyclohexyl]-methyl-(phenylmethyl)ammonium IUPAC Name: [(1R,3S)-1-(azaniumylmethyl)-3-methylcyclohexyl]-benzyl-methylazanium Traditional Name: [(1R,3S)-1-(ammoniomethyl)-3-methyl-cyclohexyl]-benzyl-methyl-ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)(C[NH3+])[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CCC[C@@](C1)(C[NH3+])[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-14-7-6-10-16(11-14,13-17)18(2)12-15-8-4-3-5-9-15/h3-5,8-9,14H,6-7,10-13,17H2,1-2H3/p+2/t14-,16+/m0/s1