[1-methyl-4-oxidanyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-phenyl-methanone bromide

Systemtic Name: [1-methyl-4-oxidanyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-phenyl-methanone bromide Openeye Name: (1-benzyl-4-hydroxy-1-methyl-piperidin-1-ium-4-yl)-phenyl-methanone bromide CAS Name: [4-hydroxy-1-methyl-1-(phenylmethyl)-4-piperidin-1-iumyl]-phenylmethanone bromide IUPAC Name: (1-benzyl-4-hydroxy-1-methylpiperidin-1-ium-4-yl)-phenylmethanone bromide Traditional Name: (1-benzyl-4-hydroxy-1-methyl-piperidin-1-ium-4-yl)-phenyl-methanone bromide Formula: C20H24BrNO2 MolecularWeight: 390.31406

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)(C(=O)C2=CC=CC=C2)O)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C[N+]1(CCC(CC1)(C(=O)C2=CC=CC=C2)O)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H24NO2.BrH/c1-21(16-17-8-4-2-5-9-17)14-12-20(23,13-15-21)19(22)18-10-6-3-7-11-18;/h2-11,23H,12-16H2,1H3;1H/q+1;/p-1