2-oxidanidyl-2-[(4-pyridin-2-yloxyphenyl)methyl]-3H-isoindol-2-ium-1-one

Systemtic Name: 2-oxidanidyl-2-[(4-pyridin-2-yloxyphenyl)methyl]-3H-isoindol-2-ium-1-one Openeye Name: 2-oxido-2-[[4-(2-pyridyloxy)phenyl]methyl]isoindolin-2-ium-1-one CAS Name: 2-oxido-2-[[4-(2-pyridinyloxy)phenyl]methyl]-3H-isoindol-2-ium-1-one IUPAC Name: 2-oxido-2-[(4-pyridin-2-yloxyphenyl)methyl]-3H-isoindol-2-ium-1-one Traditional Name: 2-oxido-2-[4-(2-pyridyloxy)benzyl]isoindolin-2-ium-1-one Formula: C20H16N2O3 MolecularWeight: 332.35264

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)[N+]1(CC3=CC=C(C=C3)OC4=CC=CC=N4)[O-]

Isomeric SMILES

C1C2=CC=CC=C2C(=O)[N+]1(CC3=CC=C(C=C3)OC4=CC=CC=N4)[O-]

InChI

InChI=1S/C20H16N2O3/c23-20-18-6-2-1-5-16(18)14-22(20,24)13-15-8-10-17(11-9-15)25-19-7-3-4-12-21-19/h1-12H,13-14H2