2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[2-[4-(phenylmethyl)piperidin-1-ium-1-yl]ethanoylamino]-N-propan-2-yl-ethanamide Openeye Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-isopropyl-acetamide CAS Name: 2-[[1-oxo-2-[4-(phenylmethyl)-1-piperidin-1-iumyl]ethyl]amino]-N-propan-2-ylacetamide IUPAC Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-propan-2-ylacetamide Traditional Name: 2-[[2-(4-benzylpiperidin-1-ium-1-yl)acetyl]amino]-N-isopropyl-acetamide Formula: C19H30N3O2+ MolecularWeight: 332.4604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CNC(=O)C[NH+]1CCC(CC1)CC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CNC(=O)C[NH+]1CCC(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C19H29N3O2/c1-15(2)21-18(23)13-20-19(24)14-22-10-8-17(9-11-22)12-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H,20,24)(H,21,23)/p+1