2-(4-phenylmethoxypiperidin-1-ium-1-yl)-N-(propan-2-ylcarbamoyl)ethanamide

Systemtic Name: 2-(4-phenylmethoxypiperidin-1-ium-1-yl)-N-(propan-2-ylcarbamoyl)ethanamide Openeye Name: 2-(4-benzyloxypiperidin-1-ium-1-yl)-N-(isopropylcarbamoyl)acetamide CAS Name: N-[oxo-(propan-2-ylamino)methyl]-2-(4-phenylmethoxy-1-piperidin-1-iumyl)acetamide IUPAC Name: 2-(4-phenylmethoxypiperidin-1-ium-1-yl)-N-(propan-2-ylcarbamoyl)acetamide Traditional Name: 2-(4-benzoxypiperidin-1-ium-1-yl)-N-(isopropylcarbamoyl)acetamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C[NH+]1CCC(CC1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)NC(=O)C[NH+]1CCC(CC1)OCC2=CC=CC=C2

InChI

InChI=1S/C18H27N3O3/c1-14(2)19-18(23)20-17(22)12-21-10-8-16(9-11-21)24-13-15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H2,19,20,22,23)/p+1