6-[(pyridin-1-ium-2-ylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-dione

Systemtic Name: 6-[(pyridin-1-ium-2-ylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-dione Openeye Name: 6-[(pyridin-1-ium-2-ylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-dione CAS Name: 6-[(2-pyridin-1-iumylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-dione IUPAC Name: 6-[(pyridin-1-ium-2-ylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-dione Traditional Name: 6-[(pyridin-1-ium-2-ylamino)methyl]pyrrolo[3,4-b]pyridine-5,7-quinone Formula: C13H11N4O2+ MolecularWeight: 255.25204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[NH+]C(=C1)NCN2C(=O)C3=C(C2=O)N=CC=C3

Isomeric SMILES

C1=CC=[NH+]C(=C1)NCN2C(=O)C3=C(C2=O)N=CC=C3

InChI

InChI=1S/C13H10N4O2/c18-12-9-4-3-7-15-11(9)13(19)17(12)8-16-10-5-1-2-6-14-10/h1-7H,8H2,(H,14,16)/p+1