N-(3-methylphenyl)-2-[2-(4-oxidanylpiperidin-1-ium-1-yl)ethanoylamino]benzamide

Systemtic Name: N-(3-methylphenyl)-2-[2-(4-oxidanylpiperidin-1-ium-1-yl)ethanoylamino]benzamide Openeye Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-(m-tolyl)benzamide CAS Name: 2-[[2-(4-hydroxy-1-piperidin-1-iumyl)-1-oxoethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-(3-methylphenyl)benzamide Traditional Name: 2-[[2-(4-hydroxypiperidin-1-ium-1-yl)acetyl]amino]-N-(m-tolyl)benzamide Formula: C21H26N3O3+ MolecularWeight: 368.44944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)O

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C2=CC=CC=C2NC(=O)C[NH+]3CCC(CC3)O

InChI

InChI=1S/C21H25N3O3/c1-15-5-4-6-16(13-15)22-21(27)18-7-2-3-8-19(18)23-20(26)14-24-11-9-17(25)10-12-24/h2-8,13,17,25H,9-12,14H2,1H3,(H,22,27)(H,23,26)/p+1