[(1S,2S)-1-(azaniumylmethyl)-2-methyl-cyclohexyl]-methyl-(phenylmethyl)azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1(C[NH3+])[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

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

InChI

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