5-(pyridin-3-ylmethylamino)isoindole-1,3-dione

Systemtic Name: 5-(pyridin-3-ylmethylamino)isoindole-1,3-dione Openeye Name: 5-(3-pyridylmethylamino)isoindoline-1,3-dione CAS Name: 5-(3-pyridinylmethylamino)isoindole-1,3-dione IUPAC Name: 5-(pyridin-3-ylmethylamino)isoindole-1,3-dione Traditional Name: 5-(3-pyridylmethylamino)isoindoline-1,3-quinone Formula: C14H11N3O2 MolecularWeight: 253.25604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

C1=CC(=CN=C1)CNC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C14H11N3O2/c18-13-11-4-3-10(6-12(11)14(19)17-13)16-8-9-2-1-5-15-7-9/h1-7,16H,8H2,(H,17,18,19)