(1-oxidanidylpyridin-1-ium-3-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone

Systemtic Name: (1-oxidanidylpyridin-1-ium-3-yl)-[4-(phenylmethyl)piperidin-1-yl]methanone Openeye Name: (4-benzyl-1-piperidyl)-(1-oxidopyridin-1-ium-3-yl)methanone CAS Name: (1-oxido-3-pyridin-1-iumyl)-[4-(phenylmethyl)-1-piperidinyl]methanone IUPAC Name: (4-benzylpiperidin-1-yl)-(1-oxidopyridin-1-ium-3-yl)methanone Traditional Name: (4-benzylpiperidino)-(1-oxidopyridin-1-ium-3-yl)methanone Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O2/c21-18(17-7-4-10-20(22)14-17)19-11-8-16(9-12-19)13-15-5-2-1-3-6-15/h1-7,10,14,16H,8-9,11-13H2