[(2S)-1-azaniumyl-4-phenyl-butan-2-yl]-cyclohexyl-methyl-azanium

Systemtic Name: [(2S)-1-azaniumyl-4-phenyl-butan-2-yl]-cyclohexyl-methyl-azanium Openeye Name: [(1S)-1-(azaniumylmethyl)-3-phenyl-propyl]-cyclohexyl-methyl-ammonium CAS Name: [(2S)-1-ammonio-4-phenylbutan-2-yl]-cyclohexyl-methylammonium IUPAC Name: [(2S)-1-azaniumyl-4-phenylbutan-2-yl]-cyclohexyl-methylazanium Traditional Name: [(1S)-1-(ammoniomethyl)-3-phenyl-propyl]-cyclohexyl-methyl-ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C1CCCCC1)C(CCC2=CC=CC=C2)C[NH3+]

Isomeric SMILES

C[NH+](C1CCCCC1)[C@@H](CCC2=CC=CC=C2)C[NH3+]

InChI

InChI=1S/C17H28N2/c1-19(16-10-6-3-7-11-16)17(14-18)13-12-15-8-4-2-5-9-15/h2,4-5,8-9,16-17H,3,6-7,10-14,18H2,1H3/p+2/t17-/m0/s1