6-nitro-2-(pyridin-2-ylmethyl)benzo[de]isoquinoline-1,3-dione

Systemtic Name: 6-nitro-2-(pyridin-2-ylmethyl)benzo[de]isoquinoline-1,3-dione Openeye Name: 6-nitro-2-(2-pyridylmethyl)benzo[de]isoquinoline-1,3-dione CAS Name: 6-nitro-2-(2-pyridinylmethyl)benzo[de]isoquinoline-1,3-dione IUPAC Name: 6-nitro-2-(pyridin-2-ylmethyl)benzo[de]isoquinoline-1,3-dione Traditional Name: 6-nitro-2-(2-pyridylmethyl)benzo[de]isoquinoline-1,3-quinone Formula: C18H11N3O4 MolecularWeight: 333.29764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)CN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

C1=CC=NC(=C1)CN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C18H11N3O4/c22-17-13-6-3-5-12-15(21(24)25)8-7-14(16(12)13)18(23)20(17)10-11-4-1-2-9-19-11/h1-9H,10H2