5-(heptan-4-ylamino)-4-oxidanylidene-3H-phthalazin-1-olate

Systemtic Name: 5-(heptan-4-ylamino)-4-oxidanylidene-3H-phthalazin-1-olate Openeye Name: 4-oxo-5-(1-propylbutylamino)-3H-phthalazin-1-olate CAS Name: 5-(heptan-4-ylamino)-4-oxo-3H-phthalazin-1-olate IUPAC Name: 5-(heptan-4-ylamino)-4-oxo-3H-phthalazin-1-olate Traditional Name: 4-keto-5-(1-propylbutylamino)-3H-phthalazin-1-olate Formula: C15H20N3O2- MolecularWeight: 274.3382

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC=CC2=C1C(=O)NN=C2[O-]

Isomeric SMILES

CCCC(CCC)NC1=CC=CC2=C1C(=O)NN=C2[O-]

InChI

InChI=1S/C15H21N3O2/c1-3-6-10(7-4-2)16-12-9-5-8-11-13(12)15(20)18-17-14(11)19/h5,8-10,16H,3-4,6-7H2,1-2H3,(H,17,19)(H,18,20)/p-1