2-[[3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[3-(2,4-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[3-(2,4-dimethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[3-(2,4-dimethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[3-(2,4-dimethoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]ethyl-diethylazanium Traditional Name: 2-[[3-(2,4-dimethoxyphenyl)-4-keto-phthalazine-1-carbonyl]amino]ethyl-diethyl-ammonium Formula: C23H29N4O4+ MolecularWeight: 425.50076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O4/c1-5-26(6-2)14-13-24-22(28)21-17-9-7-8-10-18(17)23(29)27(25-21)19-12-11-16(30-3)15-20(19)31-4/h7-12,15H,5-6,13-14H2,1-4H3,(H,24,28)/p+1