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

Systemtic Name: 2-butyl-5-diazonio-1,3-bis(oxidanylidene)benzo[de]isoquinolin-6-olate Openeye Name: 2-butyl-5-diazonio-1,3-dioxo-benzo[de]isoquinolin-6-olate CAS Name: 2-butyl-5-diazonio-1,3-dioxo-6-benzo[de]isoquinolinolate IUPAC Name: 2-butyl-5-diazonio-1,3-dioxobenzo[de]isoquinolin-6-olate Traditional Name: 2-butyl-5-diazonio-1,3-diketo-benzo[de]isoquinolin-6-olate Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O3/c1-2-3-7-19-15(21)10-6-4-5-9-13(10)11(16(19)22)8-12(18-17)14(9)20/h4-6,8H,2-3,7H2,1H3