N-oxidanyl-1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)benzo[de]isoquinolin-5-amine oxide

Systemtic Name: N-oxidanyl-1,3-bis(oxidanylidene)-2-(pyridin-3-ylmethyl)benzo[de]isoquinolin-5-amine oxide Openeye Name: N-hydroxy-1,3-dioxo-2-(3-pyridylmethyl)benzo[de]isoquinolin-5-amine oxide CAS Name: N-hydroxy-1,3-dioxo-2-(3-pyridinylmethyl)-5-benzo[de]isoquinolinamine oxide IUPAC Name: N-hydroxy-1,3-dioxo-2-(pyridin-3-ylmethyl)benzo[de]isoquinolin-5-amine oxide Traditional Name: N-hydroxy-1,3-diketo-2-(3-pyridylmethyl)benzo[de]isoquinolin-5-amine oxide Formula: C18H13N3O4 MolecularWeight: 335.31352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CC4=CN=CC=C4)[NH+](O)[O-]

Isomeric SMILES

C1=CC2=CC(=CC3=C2C(=C1)C(=O)N(C3=O)CC4=CN=CC=C4)[NH+](O)[O-]

InChI

InChI=1S/C18H13N3O4/c22-17-14-5-1-4-12-7-13(21(24)25)8-15(16(12)14)18(23)20(17)10-11-3-2-6-19-9-11/h1-9,21,24H,10H2