[(3S)-3-azaniumyl-3-phenyl-propyl]-cyclohexyl-methyl-azanium

Systemtic Name: [(3S)-3-azaniumyl-3-phenyl-propyl]-cyclohexyl-methyl-azanium Openeye Name: [(3S)-3-azaniumyl-3-phenyl-propyl]-cyclohexyl-methyl-ammonium CAS Name: [(3S)-3-ammonio-3-phenylpropyl]-cyclohexyl-methylammonium IUPAC Name: [(3S)-3-azaniumyl-3-phenylpropyl]-cyclohexyl-methylazanium Traditional Name: [(3S)-3-ammonio-3-phenyl-propyl]-cyclohexyl-methyl-ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(C1=CC=CC=C1)[NH3+])C2CCCCC2

Isomeric SMILES

C[NH+](CC[C@@H](C1=CC=CC=C1)[NH3+])C2CCCCC2

InChI

InChI=1S/C16H26N2/c1-18(15-10-6-3-7-11-15)13-12-16(17)14-8-4-2-5-9-14/h2,4-5,8-9,15-16H,3,6-7,10-13,17H2,1H3/p+2/t16-/m0/s1