[4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium

Systemtic Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Openeye Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylammonium CAS Name: [4-[[(3S,5S)-3,5-dimethyl-1-piperidin-1-iumyl]methyl]phenyl]methylammonium IUPAC Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]phenyl]methylazanium Traditional Name: [4-[[(3S,5S)-3,5-dimethylpiperidin-1-ium-1-yl]methyl]benzyl]ammonium Formula: C15H26N2+2 MolecularWeight: 234.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C[NH+](C1)CC2=CC=C(C=C2)C[NH3+])C

Isomeric SMILES

C[C@H]1C[C@@H](C[NH+](C1)CC2=CC=C(C=C2)C[NH3+])C

InChI

InChI=1S/C15H24N2/c1-12-7-13(2)10-17(9-12)11-15-5-3-14(8-16)4-6-15/h3-6,12-13H,7-11,16H2,1-2H3/p+2/t12-,13-/m0/s1