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

Systemtic Name: 2-[[3-(3-methoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[3-(3-methoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[3-(3-methoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[3-(3-methoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[4-keto-3-(3-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=C3)OC

Isomeric SMILES

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

InChI

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