5,6-bis(pyridin-4-ylamino)isoindole-1,3-dione

Systemtic Name: 5,6-bis(pyridin-4-ylamino)isoindole-1,3-dione Openeye Name: 5,6-bis(4-pyridylamino)isoindoline-1,3-dione CAS Name: 5,6-bis(pyridin-4-ylamino)isoindole-1,3-dione IUPAC Name: 5,6-bis(pyridin-4-ylamino)isoindole-1,3-dione Traditional Name: 5,6-bis(4-pyridylamino)isoindoline-1,3-quinone Formula: C18H13N5O2 MolecularWeight: 331.32812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CC=C1NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC=NC=C4

Isomeric SMILES

C1=CN=CC=C1NC2=C(C=C3C(=C2)C(=O)NC3=O)NC4=CC=NC=C4

InChI

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