2-butyl-6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-5-olate

Systemtic Name: 2-butyl-6-nitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-5-olate Openeye Name: 2-butyl-6-nitro-1,3-dioxo-benzo[de]isoquinolin-5-olate CAS Name: 2-butyl-6-nitro-1,3-dioxo-5-benzo[de]isoquinolinolate IUPAC Name: 2-butyl-6-nitro-1,3-dioxobenzo[de]isoquinolin-5-olate Traditional Name: 2-butyl-1,3-diketo-6-nitro-benzo[de]isoquinolin-5-olate Formula: C16H13N2O5- MolecularWeight: 313.28482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC3=C2C(=CC(=C3[N+](=O)[O-])[O-])C1=O

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC3=C2C(=CC(=C3[N+](=O)[O-])[O-])C1=O

InChI

InChI=1S/C16H14N2O5/c1-2-3-7-17-15(20)10-6-4-5-9-13(10)11(16(17)21)8-12(19)14(9)18(22)23/h4-6,8,19H,2-3,7H2,1H3/p-1