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

Systemtic Name: [(1R,2S)-1-(azaniumylmethyl)-2-methyl-cyclohexyl]-ethyl-(phenylmethyl)azanium Openeye Name: [(1R,2S)-1-(azaniumylmethyl)-2-methyl-cyclohexyl]-benzyl-ethyl-ammonium CAS Name: [(1R,2S)-1-(ammoniomethyl)-2-methylcyclohexyl]-ethyl-(phenylmethyl)ammonium IUPAC Name: [(1R,2S)-1-(azaniumylmethyl)-2-methylcyclohexyl]-benzyl-ethylazanium Traditional Name: [(1R,2S)-1-(ammoniomethyl)-2-methyl-cyclohexyl]-benzyl-ethyl-ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)C2(CCCCC2C)C[NH3+]

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)[C@@]2(CCCC[C@@H]2C)C[NH3+]

InChI

InChI=1S/C17H28N2/c1-3-19(13-16-10-5-4-6-11-16)17(14-18)12-8-7-9-15(17)2/h4-6,10-11,15H,3,7-9,12-14,18H2,1-2H3/p+2/t15-,17-/m0/s1