7-[4-azaniumylbutyl(ethyl)amino]-4-oxidanylidene-3H-phthalazin-1-olate

Systemtic Name: 7-[4-azaniumylbutyl(ethyl)amino]-4-oxidanylidene-3H-phthalazin-1-olate Openeye Name: 7-[4-azaniumylbutyl(ethyl)amino]-4-oxo-3H-phthalazin-1-olate CAS Name: 7-[4-ammoniobutyl(ethyl)amino]-4-oxo-3H-phthalazin-1-olate IUPAC Name: 7-[4-azaniumylbutyl(ethyl)amino]-4-oxo-3H-phthalazin-1-olate Traditional Name: 7-[4-ammoniobutyl(ethyl)amino]-4-keto-3H-phthalazin-1-olate Formula: C14H20N4O2 MolecularWeight: 276.3342

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC[NH3+])C1=CC2=C(C=C1)C(=O)NN=C2[O-]

Isomeric SMILES

CCN(CCCC[NH3+])C1=CC2=C(C=C1)C(=O)NN=C2[O-]

InChI

InChI=1S/C14H20N4O2/c1-2-18(8-4-3-7-15)10-5-6-11-12(9-10)14(20)17-16-13(11)19/h5-6,9H,2-4,7-8,15H2,1H3,(H,16,19)(H,17,20)