6-nitro-3-oxidanylidene-2-quinolin-2-yl-phenalen-1-olate

Systemtic Name: 6-nitro-3-oxidanylidene-2-quinolin-2-yl-phenalen-1-olate Openeye Name: 6-nitro-3-oxo-2-(2-quinolyl)phenalen-1-olate CAS Name: 6-nitro-3-oxo-2-(2-quinolinyl)-1-phenalenolate IUPAC Name: 6-nitro-3-oxo-2-quinolin-2-ylphenalen-1-olate Traditional Name: 3-keto-6-nitro-2-(2-quinolyl)phenalen-1-olate Formula: C22H11N2O4- MolecularWeight: 367.33374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=CC=CC5=C(C=CC(=C54)C3=O)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C3=C(C4=CC=CC5=C(C=CC(=C54)C3=O)[N+](=O)[O-])[O-]

InChI

InChI=1S/C22H12N2O4/c25-21-14-6-3-5-13-18(24(27)28)11-9-15(19(13)14)22(26)20(21)17-10-8-12-4-1-2-7-16(12)23-17/h1-11,25H/p-1