N-(3-azanyl-2-methyl-phenyl)-4-(4-oxidanylpiperidin-1-ium-1-yl)butanamide

Systemtic Name: N-(3-azanyl-2-methyl-phenyl)-4-(4-oxidanylpiperidin-1-ium-1-yl)butanamide Openeye Name: N-(3-amino-2-methyl-phenyl)-4-(4-hydroxypiperidin-1-ium-1-yl)butanamide CAS Name: N-(3-amino-2-methylphenyl)-4-(4-hydroxy-1-piperidin-1-iumyl)butanamide IUPAC Name: N-(3-amino-2-methylphenyl)-4-(4-hydroxypiperidin-1-ium-1-yl)butanamide Traditional Name: N-(3-amino-2-methyl-phenyl)-4-(4-hydroxypiperidin-1-ium-1-yl)butyramide Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCC[NH+]2CCC(CC2)O)N

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCC[NH+]2CCC(CC2)O)N

InChI

InChI=1S/C16H25N3O2/c1-12-14(17)4-2-5-15(12)18-16(21)6-3-9-19-10-7-13(20)8-11-19/h2,4-5,13,20H,3,6-11,17H2,1H3,(H,18,21)/p+1