2-(2-phenoxyethanoylamino)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(2-phenoxyethanoylamino)-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-[(2-phenoxyacetyl)amino]-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(1-oxo-2-phenoxyethyl)amino]-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-[(2-phenoxyacetyl)amino]-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-[(2-phenoxyacetyl)amino]-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c27-22(16-25-23(28)18-29-21-11-3-1-4-12-21)24-15-19-9-5-6-10-20(19)17-26-13-7-2-8-14-26/h1,3-6,9-12H,2,7-8,13-18H2,(H,24,27)(H,25,28)/p+1