N-methyl-1-[2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-1-[2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-1-[2-[[2-(morpholinomethyl)phenyl]methylamino]-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[2-[[2-(4-morpholinylmethyl)phenyl]methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[2-[[2-(morpholin-4-ylmethyl)phenyl]methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-keto-2-[[2-(morpholinomethyl)benzyl]amino]ethyl]-N-methyl-piperidin-1-ium-4-carboxamide Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1CC[NH+](CC1)CC(=O)NCC2=CC=CC=C2CN3CCOCC3

Isomeric SMILES

CNC(=O)C1CC[NH+](CC1)CC(=O)NCC2=CC=CC=C2CN3CCOCC3

InChI

InChI=1S/C21H32N4O3/c1-22-21(27)17-6-8-24(9-7-17)16-20(26)23-14-18-4-2-3-5-19(18)15-25-10-12-28-13-11-25/h2-5,17H,6-16H2,1H3,(H,22,27)(H,23,26)/p+1