3-(3,5-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-(3,5-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-(3,5-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: 3-(3,5-dimethoxyphenyl)-N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-(3,5-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-(3,5-dimethoxyphenyl)-N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-4-keto-phthalazine-1-carboxamide Formula: C24H29N4O4+ MolecularWeight: 437.51146

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC(=CC(=C4)OC)OC

InChI

InChI=1S/C24H28N4O4/c1-4-27-11-7-8-16(27)15-25-23(29)22-20-9-5-6-10-21(20)24(30)28(26-22)17-12-18(31-2)14-19(13-17)32-3/h5-6,9-10,12-14,16H,4,7-8,11,15H2,1-3H3,(H,25,29)/p+1