5-[[(2S)-2-methylpentyl]amino]-4-oxidanylidene-3H-phthalazin-1-olate

Systemtic Name: 5-[[(2S)-2-methylpentyl]amino]-4-oxidanylidene-3H-phthalazin-1-olate Openeye Name: 5-[[(2S)-2-methylpentyl]amino]-4-oxo-3H-phthalazin-1-olate CAS Name: 5-[[(2S)-2-methylpentyl]amino]-4-oxo-3H-phthalazin-1-olate IUPAC Name: 5-[[(2S)-2-methylpentyl]amino]-4-oxo-3H-phthalazin-1-olate Traditional Name: 4-keto-5-[[(2S)-2-methylpentyl]amino]-3H-phthalazin-1-olate Formula: C14H18N3O2- MolecularWeight: 260.31162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)CNC1=CC=CC2=C1C(=O)NN=C2[O-]

Isomeric SMILES

CCC[C@H](C)CNC1=CC=CC2=C1C(=O)NN=C2[O-]

InChI

InChI=1S/C14H19N3O2/c1-3-5-9(2)8-15-11-7-4-6-10-12(11)14(19)17-16-13(10)18/h4,6-7,9,15H,3,5,8H2,1-2H3,(H,16,18)(H,17,19)/p-1/t9-/m0/s1