1-(4-methoxyphenyl)-N-[(2S,4R,5S)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine

Systemtic Name: 1-(4-methoxyphenyl)-N-[(2S,4R,5S)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine Openeye Name: 1-(4-methoxyphenyl)-N-[(2S,4R,5S)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine CAS Name: 1-(4-methoxyphenyl)-N-[(2S,4R,5S)-1,2,5-trimethyl-4-piperidin-1-iumyl]methanimine IUPAC Name: 1-(4-methoxyphenyl)-N-[(2S,4R,5S)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine Traditional Name: p-anisylidene-[(2S,4R,5S)-1,2,5-trimethylpiperidin-1-ium-4-yl]amine Formula: C16H25N2O+ MolecularWeight: 261.3825

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C[NH+]1C)C)N=CC2=CC=C(C=C2)OC

Isomeric SMILES

C[C@H]1C[C@H]([C@H](C[NH+]1C)C)N=CC2=CC=C(C=C2)OC

InChI

InChI=1S/C16H24N2O/c1-12-11-18(3)13(2)9-16(12)17-10-14-5-7-15(19-4)8-6-14/h5-8,10,12-13,16H,9,11H2,1-4H3/p+1/t12-,13-,16+/m0/s1