N-[6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-2-phenoxy-ethanamide

Systemtic Name: N-[6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-2-phenoxy-ethanamide Openeye Name: N-(6-nitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-2-phenoxy-acetamide CAS Name: N-(6-nitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-2-phenoxyacetamide IUPAC Name: N-(6-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-2-phenoxyacetamide Traditional Name: N-(1,3-diketo-6-nitro-benzo[de]isoquinolin-2-yl)-2-phenoxy-acetamide Formula: C20H13N3O6 MolecularWeight: 391.33372

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(=O)NN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

Isomeric SMILES

C1=CC=C(C=C1)OCC(=O)NN2C(=O)C3=C4C(=C(C=C3)[N+](=O)[O-])C=CC=C4C2=O

InChI

InChI=1S/C20H13N3O6/c24-17(11-29-12-5-2-1-3-6-12)21-22-19(25)14-8-4-7-13-16(23(27)28)10-9-15(18(13)14)20(22)26/h1-10H,11H2,(H,21,24)