methyl-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonylamino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]propyl]ammonium CAS Name: methyl-[3-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[(4-oxo-3H-phthalazine-1-carbonyl)amino]propyl]azanium Traditional Name: benzyl-[3-[(4-keto-3H-phthalazine-1-carbonyl)amino]propyl]-methyl-ammonium Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCCNC(=O)C1=NNC(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

C[NH+](CCCNC(=O)C1=NNC(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2/c1-24(14-15-8-3-2-4-9-15)13-7-12-21-20(26)18-16-10-5-6-11-17(16)19(25)23-22-18/h2-6,8-11H,7,12-14H2,1H3,(H,21,26)(H,23,25)/p+1