butyl-[2-[[3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl]-ethyl-azanium

Systemtic Name: butyl-[2-[[3-(3,5-dimethoxyphenyl)-4-oxidanylidene-phthalazin-1-yl]carbonylamino]ethyl]-ethyl-azanium Openeye Name: butyl-[2-[[3-(3,5-dimethoxyphenyl)-4-oxo-phthalazine-1-carbonyl]amino]ethyl]-ethyl-ammonium CAS Name: butyl-[2-[[[3-(3,5-dimethoxyphenyl)-4-oxo-1-phthalazinyl]-oxomethyl]amino]ethyl]-ethylammonium IUPAC Name: butyl-[2-[[3-(3,5-dimethoxyphenyl)-4-oxophthalazine-1-carbonyl]amino]ethyl]-ethylazanium Traditional Name: butyl-[2-[[3-(3,5-dimethoxyphenyl)-4-keto-phthalazine-1-carbonyl]amino]ethyl]-ethyl-ammonium Formula: C25H33N4O4+ MolecularWeight: 453.55392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H32N4O4/c1-5-7-13-28(6-2)14-12-26-24(30)23-21-10-8-9-11-22(21)25(31)29(27-23)18-15-19(32-3)17-20(16-18)33-4/h8-11,15-17H,5-7,12-14H2,1-4H3,(H,26,30)/p+1