[(1S,2S,5S)-2-azaniumyl-5-phenyl-cyclohexyl]-butyl-methyl-azanium

Systemtic Name: [(1S,2S,5S)-2-azaniumyl-5-phenyl-cyclohexyl]-butyl-methyl-azanium Openeye Name: [(1S,2S,5S)-2-azaniumyl-5-phenyl-cyclohexyl]-butyl-methyl-ammonium CAS Name: [(1S,2S,5S)-2-ammonio-5-phenylcyclohexyl]-butyl-methylammonium IUPAC Name: [(1S,2S,5S)-2-azaniumyl-5-phenylcyclohexyl]-butyl-methylazanium Traditional Name: [(1S,2S,5S)-2-ammonio-5-phenyl-cyclohexyl]-butyl-methyl-ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)C1CC(CCC1[NH3+])C2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2/c1-3-4-12-19(2)17-13-15(10-11-16(17)18)14-8-6-5-7-9-14/h5-9,15-17H,3-4,10-13,18H2,1-2H3/p+2/t15-,16-,17-/m0/s1