[(3S)-1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-3-yl]azanium

Systemtic Name: [(3S)-1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-3-yl]azanium Openeye Name: [(3S)-1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-3-yl]ammonium CAS Name: [(3S)-1-[(4-dimethylaminophenyl)methyl]-3-piperidin-1-iumyl]ammonium IUPAC Name: [(3S)-1-[(4-dimethylaminophenyl)methyl]piperidin-1-ium-3-yl]azanium Traditional Name: [(3S)-1-[4-(dimethylamino)benzyl]piperidin-1-ium-3-yl]ammonium Formula: C14H25N3+2 MolecularWeight: 235.3684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C[NH+]2CCCC(C2)[NH3+]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C[NH+]2CCC[C@@H](C2)[NH3+]

InChI

InChI=1S/C14H23N3/c1-16(2)14-7-5-12(6-8-14)10-17-9-3-4-13(15)11-17/h5-8,13H,3-4,9-11,15H2,1-2H3/p+2/t13-/m0/s1