2-[[(E)-[1-(3-pyridin-1-ium-1-ylpropyl)pyridin-1-ium-4-yl]methylideneamino]oxymethyl]isoindole-1,3-dione

Systemtic Name: 2-[[(E)-[1-(3-pyridin-1-ium-1-ylpropyl)pyridin-1-ium-4-yl]methylideneamino]oxymethyl]isoindole-1,3-dione Openeye Name: 2-[[(E)-[1-(3-pyridin-1-ium-1-ylpropyl)pyridin-1-ium-4-yl]methyleneamino]oxymethyl]isoindoline-1,3-dione CAS Name: 2-[[(E)-[1-[3-(1-pyridin-1-iumyl)propyl]-4-pyridin-1-iumyl]methylideneamino]oxymethyl]isoindole-1,3-dione IUPAC Name: 2-[[(E)-[1-(3-pyridin-1-ium-1-ylpropyl)pyridin-1-ium-4-yl]methylideneamino]oxymethyl]isoindole-1,3-dione Traditional Name: 2-[[(E)-[1-(3-pyridin-1-ium-1-ylpropyl)pyridin-1-ium-4-yl]methyleneamino]oxymethyl]isoindoline-1,3-quinone Formula: C23H22N4O3+2 MolecularWeight: 402.44578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CCC[N+]2=CC=C(C=C2)C=NOCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=[N+](C=C1)CCC[N+]2=CC=C(C=C2)/C=N/OCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C23H22N4O3/c28-22-20-7-2-3-8-21(20)23(29)27(22)18-30-24-17-19-9-15-26(16-10-19)14-6-13-25-11-4-1-5-12-25/h1-5,7-12,15-17H,6,13-14,18H2/q+2/b24-17+