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

Systemtic Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]phenyl]methylazanium Openeye Name: [4-[(3S,5S)-3,5-dimethyl-1-piperidyl]phenyl]methylammonium CAS Name: [4-[(3S,5S)-3,5-dimethyl-1-piperidinyl]phenyl]methylammonium IUPAC Name: [4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]phenyl]methylazanium Traditional Name: [4-[(3S,5S)-3,5-dimethylpiperidino]benzyl]ammonium Formula: C14H23N2+ MolecularWeight: 219.34582

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N2/c1-11-7-12(2)10-16(9-11)14-5-3-13(8-15)4-6-14/h3-6,11-12H,7-10,15H2,1-2H3/p+1/t11-,12-/m0/s1