[3-oxidanylidene-2-(phenylmethyl)isoindol-2-ium-1-yl] hydrogen sulfate

Systemtic Name: [3-oxidanylidene-2-(phenylmethyl)isoindol-2-ium-1-yl] hydrogen sulfate Openeye Name: (2-benzyl-3-oxo-isoindol-2-ium-1-yl) hydrogen sulfate CAS Name: sulfuric acid [3-oxo-2-(phenylmethyl)-1-isoindol-2-iumyl] ester IUPAC Name: (2-benzyl-3-oxoisoindol-2-ium-1-yl) hydrogen sulfate Traditional Name: sulfuric acid (2-benzyl-3-keto-isoindol-2-ium-1-yl) ester Formula: C15H12NO5S+ MolecularWeight: 318.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3C2=O)OS(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C[N+]2=C(C3=CC=CC=C3C2=O)OS(=O)(=O)O

InChI

InChI=1S/C15H11NO5S/c17-14-12-8-4-5-9-13(12)15(21-22(18,19)20)16(14)10-11-6-2-1-3-7-11/h1-9H,10H2/p+1