N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-N-methyl-ethanamide

Systemtic Name: N-[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-N-methyl-ethanamide Openeye Name: N-[2-(2,5-dimethylanilino)-2-oxo-ethyl]-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-N-methyl-acetamide CAS Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-[(2S)-2-ethyl-1-piperidin-1-iumyl]-N-methylacetamide IUPAC Name: N-[2-(2,5-dimethylanilino)-2-oxoethyl]-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-N-methylacetamide Traditional Name: N-[2-(2,5-dimethylanilino)-2-keto-ethyl]-2-[(2S)-2-ethylpiperidin-1-ium-1-yl]-N-methyl-acetamide Formula: C20H32N3O2+ MolecularWeight: 346.48698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC(=O)N(C)CC(=O)NC2=C(C=CC(=C2)C)C

Isomeric SMILES

CC[C@H]1CCCC[NH+]1CC(=O)N(C)CC(=O)NC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H31N3O2/c1-5-17-8-6-7-11-23(17)14-20(25)22(4)13-19(24)21-18-12-15(2)9-10-16(18)3/h9-10,12,17H,5-8,11,13-14H2,1-4H3,(H,21,24)/p+1/t17-/m0/s1