2-[3-(4-oxidanylidene-3H-phthalazin-1-yl)propanoylamino]ethylazanium

Systemtic Name: 2-[3-(4-oxidanylidene-3H-phthalazin-1-yl)propanoylamino]ethylazanium Openeye Name: 2-[3-(4-oxo-3H-phthalazin-1-yl)propanoylamino]ethylammonium CAS Name: 2-[[1-oxo-3-(4-oxo-3H-phthalazin-1-yl)propyl]amino]ethylammonium IUPAC Name: 2-[3-(4-oxo-3H-phthalazin-1-yl)propanoylamino]ethylazanium Traditional Name: 2-[3-(4-keto-3H-phthalazin-1-yl)propanoylamino]ethylammonium Formula: C13H17N4O2+ MolecularWeight: 261.29968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CCC(=O)NCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CCC(=O)NCC[NH3+]

InChI

InChI=1S/C13H16N4O2/c14-7-8-15-12(18)6-5-11-9-3-1-2-4-10(9)13(19)17-16-11/h1-4H,5-8,14H2,(H,15,18)(H,17,19)/p+1