[(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium

Systemtic Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium Openeye Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methyl-4-piperidyl)ammonium CAS Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methyl-4-piperidinyl)ammonium IUPAC Name: [(1S)-2-azaniumyl-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methylpiperidin-4-yl)azanium Traditional Name: [(1S)-2-ammonio-1-(4-dimethylaminophenyl)ethyl]-methyl-(1-methyl-4-piperidyl)ammonium Formula: C17H32N4+2 MolecularWeight: 292.46278

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)[NH+](C)C(C[NH3+])C2=CC=C(C=C2)N(C)C

Isomeric SMILES

CN1CCC(CC1)[NH+](C)[C@H](C[NH3+])C2=CC=C(C=C2)N(C)C

InChI

InChI=1S/C17H30N4/c1-19(2)15-7-5-14(6-8-15)17(13-18)21(4)16-9-11-20(3)12-10-16/h5-8,16-17H,9-13,18H2,1-4H3/p+2/t17-/m1/s1