5,6-bis(pyridin-2-ylamino)isoindole-1,3-dione

Systemtic Name: 5,6-bis(pyridin-2-ylamino)isoindole-1,3-dione Openeye Name: 5,6-bis(2-pyridylamino)isoindoline-1,3-dione CAS Name: 5,6-bis(2-pyridinylamino)isoindole-1,3-dione IUPAC Name: 5,6-bis(pyridin-2-ylamino)isoindole-1,3-dione Traditional Name: 5,6-bis(2-pyridylamino)isoindoline-1,3-quinone Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC=CC=N4

Isomeric SMILES

C1=CC=NC(=C1)NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC=CC=N4

InChI

InChI=1S/C18H13N5O2/c24-17-11-9-13(21-15-5-1-3-7-19-15)14(10-12(11)18(25)23-17)22-16-6-2-4-8-20-16/h1-10H,(H,19,21)(H,20,22)(H,23,24,25)