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

Systemtic Name: bis(azanyl)methylidene-[4-[2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanoylamino]butyl]azanium Openeye Name: diaminomethylene-[4-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]butyl]ammonium CAS Name: diaminomethylidene-[4-[[1-oxo-2-(4-oxo-3H-phthalazin-1-yl)ethyl]amino]butyl]ammonium IUPAC Name: diaminomethylidene-[4-[[2-(4-oxo-3H-phthalazin-1-yl)acetyl]amino]butyl]azanium Traditional Name: diaminomethylene-[4-[[2-(4-keto-3H-phthalazin-1-yl)acetyl]amino]butyl]ammonium Formula: C15H21N6O2+ MolecularWeight: 317.36624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N6O2/c16-15(17)19-8-4-3-7-18-13(22)9-12-10-5-1-2-6-11(10)14(23)21-20-12/h1-2,5-6H,3-4,7-9H2,(H,18,22)(H,21,23)(H4,16,17,19)/p+1