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

Systemtic Name: N-(phenylmethyl)-1-[(2S,4S,5R)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine Openeye Name: N-benzyl-1-[(2S,4S,5R)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine CAS Name: N-(phenylmethyl)-1-[(2S,4S,5R)-1,2,5-trimethyl-4-piperidin-1-iumyl]methanimine IUPAC Name: N-benzyl-1-[(2S,4S,5R)-1,2,5-trimethylpiperidin-1-ium-4-yl]methanimine Traditional Name: benzyl-[[(2S,4S,5R)-1,2,5-trimethylpiperidin-1-ium-4-yl]methylene]amine Formula: C16H25N2+ MolecularWeight: 245.3831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C[NH+]1C)C)C=NCC2=CC=CC=C2

Isomeric SMILES

C[C@H]1C[C@@H]([C@H](C[NH+]1C)C)C=NCC2=CC=CC=C2

InChI

InChI=1S/C16H24N2/c1-13-12-18(3)14(2)9-16(13)11-17-10-15-7-5-4-6-8-15/h4-8,11,13-14,16H,9-10,12H2,1-3H3/p+1/t13-,14-,16+/m0/s1