2-[2-(4-methoxyphenyl)-2-oxidanidyl-isoindol-2-ium-1-yl]-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[2-(4-methoxyphenyl)-2-oxidanidyl-isoindol-2-ium-1-yl]-1-piperidin-1-yl-ethanone Openeye Name: 2-[2-(4-methoxyphenyl)-2-oxido-isoindol-2-ium-1-yl]-1-(1-piperidyl)ethanone CAS Name: 2-[2-(4-methoxyphenyl)-2-oxido-1-isoindol-2-iumyl]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[2-(4-methoxyphenyl)-2-oxidoisoindol-2-ium-1-yl]-1-piperidin-1-ylethanone Traditional Name: 2-[2-(4-methoxyphenyl)-2-oxido-isoindol-2-ium-1-yl]-1-piperidino-ethanone Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2(C=C3C=CC=CC3=C2CC(=O)N4CCCCC4)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2(C=C3C=CC=CC3=C2CC(=O)N4CCCCC4)[O-]

InChI

InChI=1S/C22H24N2O3/c1-27-19-11-9-18(10-12-19)24(26)16-17-7-3-4-8-20(17)21(24)15-22(25)23-13-5-2-6-14-23/h3-4,7-12,16H,2,5-6,13-15H2,1H3