2-(3-oxidanylpyridin-1-ium-1-yl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(3-oxidanylpyridin-1-ium-1-yl)-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-(3-hydroxypyridin-1-ium-1-yl)ethanone CAS Name: 2-(3-hydroxy-1-pyridin-1-iumyl)-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-(3-hydroxypyridin-1-ium-1-yl)ethanone Traditional Name: 1-(4-benzylpiperidino)-2-(3-hydroxypyridin-1-ium-1-yl)ethanone Formula: C19H23N2O2+ MolecularWeight: 311.39812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C[N+]3=CC=CC(=C3)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C[N+]3=CC=CC(=C3)O

InChI

InChI=1S/C19H22N2O2/c22-18-7-4-10-20(14-18)15-19(23)21-11-8-17(9-12-21)13-16-5-2-1-3-6-16/h1-7,10,14,17H,8-9,11-13,15H2/p+1