2-pyridin-1-ium-3-ylisoquinoline-1,3,4-trione chloride

Systemtic Name: 2-pyridin-1-ium-3-ylisoquinoline-1,3,4-trione chloride Openeye Name: 2-pyridin-1-ium-3-ylisoquinoline-1,3,4-trione chloride CAS Name: 2-(3-pyridin-1-iumyl)isoquinoline-1,3,4-trione chloride IUPAC Name: 2-pyridin-1-ium-3-ylisoquinoline-1,3,4-trione chloride Traditional Name: 2-pyridin-1-ium-3-ylisoquinoline-1,3,4-trione chloride Formula: C14H9ClN2O3 MolecularWeight: 288.68586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=O)N(C2=O)C3=C[NH+]=CC=C3.[Cl-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=O)N(C2=O)C3=C[NH+]=CC=C3.[Cl-]

InChI

InChI=1S/C14H8N2O3.ClH/c17-12-10-5-1-2-6-11(10)13(18)16(14(12)19)9-4-3-7-15-8-9;/h1-8H;1H