5-(3-nitrophenoxy)-2-pyridin-1-ium-3-yl-isoindole-1,3-dione

Systemtic Name: 5-(3-nitrophenoxy)-2-pyridin-1-ium-3-yl-isoindole-1,3-dione Openeye Name: 5-(3-nitrophenoxy)-2-pyridin-1-ium-3-yl-isoindoline-1,3-dione CAS Name: 5-(3-nitrophenoxy)-2-(3-pyridin-1-iumyl)isoindole-1,3-dione IUPAC Name: 5-(3-nitrophenoxy)-2-pyridin-1-ium-3-ylisoindole-1,3-dione Traditional Name: 5-(3-nitrophenoxy)-2-pyridin-1-ium-3-yl-isoindoline-1,3-quinone Formula: C19H12N3O5+ MolecularWeight: 362.31568

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C[NH+]=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C[NH+]=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H11N3O5/c23-18-16-7-6-15(27-14-5-1-3-12(9-14)22(25)26)10-17(16)19(24)21(18)13-4-2-8-20-11-13/h1-11H/p+1