5-(butylamino)-4-oxidanylidene-3H-phthalazin-1-olate

Systemtic Name: 5-(butylamino)-4-oxidanylidene-3H-phthalazin-1-olate Openeye Name: 5-(butylamino)-4-oxo-3H-phthalazin-1-olate CAS Name: 5-(butylamino)-4-oxo-3H-phthalazin-1-olate IUPAC Name: 5-(butylamino)-4-oxo-3H-phthalazin-1-olate Traditional Name: 5-(butylamino)-4-keto-3H-phthalazin-1-olate Formula: C12H14N3O2- MolecularWeight: 232.25846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC2=C1C(=O)NN=C2[O-]

Isomeric SMILES

CCCCNC1=CC=CC2=C1C(=O)NN=C2[O-]

InChI

InChI=1S/C12H15N3O2/c1-2-3-7-13-9-6-4-5-8-10(9)12(17)15-14-11(8)16/h4-6,13H,2-3,7H2,1H3,(H,14,16)(H,15,17)/p-1