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bis(azanyl)methylidene-[2-[3-(4-oxidanylidene-3H-phthalazin-1-yl)propanoylamino]ethyl]azanium

bis(azanyl)methylidene-[2-[3-(4-oxidanylidene-3H-phthalazin-1-yl)propanoylamino]ethyl]azanium

Systemtic Name:bis(azanyl)methylidene-[2-[3-(4-oxidanylidene-3H-phthalazin-1-yl)propanoylamino]ethyl]azanium
Openeye Name:diaminomethylene-[2-[3-(4-oxo-3H-phthalazin-1-yl)propanoylamino]ethyl]ammonium
CAS Name:diaminomethylidene-[2-[[1-oxo-3-(4-oxo-3H-phthalazin-1-yl)propyl]amino]ethyl]ammonium
IUPAC Name:diaminomethylidene-[2-[3-(4-oxo-3H-phthalazin-1-yl)propanoylamino]ethyl]azanium
Traditional Name:diaminomethylene-[2-[3-(4-keto-3H-phthalazin-1-yl)propanoylamino]ethyl]ammonium
Formula: C14H19N6O2+
MolecularWeight: 303.33966
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CCC(=O)NCC[NH+]=C(N)N


Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CCC(=O)NCC[NH+]=C(N)N


InChI

InChI=1S/C14H18N6O2/c15-14(16)18-8-7-17-12(21)6-5-11-9-3-1-2-4-10(9)13(22)20-19-11/h1-4H,5-8H2,(H,17,21)(H,20,22)(H4,15,16,18)/p+1


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