[(2S)-1-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]piperidin-1-ium-2-yl]methylazanium

Systemtic Name: [(2S)-1-[(4-methoxy-3,5-dimethyl-pyridin-2-yl)methyl]piperidin-1-ium-2-yl]methylazanium Openeye Name: [(2S)-1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]piperidin-1-ium-2-yl]methylammonium CAS Name: [(2S)-1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]-2-piperidin-1-iumyl]methylammonium IUPAC Name: [(2S)-1-[(4-methoxy-3,5-dimethylpyridin-2-yl)methyl]piperidin-1-ium-2-yl]methylazanium Traditional Name: [(2S)-1-[(4-methoxy-3,5-dimethyl-2-pyridyl)methyl]piperidin-1-ium-2-yl]methylammonium Formula: C15H27N3O+2 MolecularWeight: 265.39438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=C1OC)C)C[NH+]2CCCCC2C[NH3+]

Isomeric SMILES

CC1=CN=C(C(=C1OC)C)C[NH+]2CCCC[C@H]2C[NH3+]

InChI

InChI=1S/C15H25N3O/c1-11-9-17-14(12(2)15(11)19-3)10-18-7-5-4-6-13(18)8-16/h9,13H,4-8,10,16H2,1-3H3/p+2/t13-/m0/s1