2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfonyl-1-[4-(phenylcarbonyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzoyl-1-piperidyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfonyl-ethanone CAS Name: 1-(4-benzoyl-1-piperidinyl)-2-[(1-oxido-2-pyridin-1-iumyl)sulfonyl]ethanone IUPAC Name: 1-(4-benzoylpiperidin-1-yl)-2-(1-oxidopyridin-1-ium-2-yl)sulfonylethanone Traditional Name: 1-(4-benzoylpiperidino)-2-(1-oxidopyridin-1-ium-2-yl)sulfonyl-ethanone Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)CS(=O)(=O)C3=CC=CC=[N+]3[O-]

Isomeric SMILES

C1CN(CCC1C(=O)C2=CC=CC=C2)C(=O)CS(=O)(=O)C3=CC=CC=[N+]3[O-]

InChI

InChI=1S/C19H20N2O5S/c22-17(14-27(25,26)18-8-4-5-11-21(18)24)20-12-9-16(10-13-20)19(23)15-6-2-1-3-7-15/h1-8,11,16H,9-10,12-14H2