[(1S,2S,5R)-2-azaniumyl-5-phenyl-cyclohexyl]-dipropyl-azanium

Systemtic Name: [(1S,2S,5R)-2-azaniumyl-5-phenyl-cyclohexyl]-dipropyl-azanium Openeye Name: [(1S,2S,5R)-2-azaniumyl-5-phenyl-cyclohexyl]-dipropyl-ammonium CAS Name: [(1S,2S,5R)-2-ammonio-5-phenylcyclohexyl]-dipropylammonium IUPAC Name: [(1S,2S,5R)-2-azaniumyl-5-phenylcyclohexyl]-dipropylazanium Traditional Name: [(1S,2S,5R)-2-ammonio-5-phenyl-cyclohexyl]-dipropyl-ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2/c1-3-12-20(13-4-2)18-14-16(10-11-17(18)19)15-8-6-5-7-9-15/h5-9,16-18H,3-4,10-14,19H2,1-2H3/p+2/t16-,17+,18+/m1/s1