2-[[3-(2-methoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[3-(2-methoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-(2-methoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-(2-methoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-(2-methoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-keto-3-(2-methoxyphenyl)phthalazine-1-carbonyl]amino]ethyl-dimethyl-ammonium Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3OC

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3OC

InChI

InChI=1S/C20H22N4O3/c1-23(2)13-12-21-19(25)18-14-8-4-5-9-15(14)20(26)24(22-18)16-10-6-7-11-17(16)27-3/h4-11H,12-13H2,1-3H3,(H,21,25)/p+1