N-(2-methylpropyl)-2-[2-(4-oxidanylpiperidin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(2-methylpropyl)-2-[2-(4-oxidanylpiperidin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-isobutyl-benzamide CAS Name: 2-[[2-(4-hydroxy-1-piperidin-1-iumyl)-1-oxoethyl]amino]-N-(2-methylpropyl)benzamide IUPAC Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-(2-methylpropyl)benzamide Traditional Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-isobutyl-benzamide Formula: C18H28N3O3+ MolecularWeight: 334.43322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)O

Isomeric SMILES

CC(C)CNC(=O)C1=CC=CC=C1NC(=O)C[NH+]2CCC(CC2)O

InChI

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