1-[2-(dimethylazaniumyl)ethyl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(2-methoxyphenyl)-5-oxidanylidene-2H-pyrrol-4-olate

Systemtic Name: 1-[2-(dimethylazaniumyl)ethyl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(2-methoxyphenyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: 1-[2-(dimethylammonio)ethyl]-3-(7-methoxybenzofuran-2-carbonyl)-2-(2-methoxyphenyl)-5-oxo-2H-pyrrol-4-olate CAS Name: 1-[2-(dimethylammonio)ethyl]-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(2-methoxyphenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: 1-[2-(dimethylazaniumyl)ethyl]-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(2-methoxyphenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: 1-[2-(dimethylammonio)ethyl]-2-keto-4-(7-methoxybenzofuran-2-carbonyl)-5-(2-methoxyphenyl)-3-pyrrolin-3-olate Formula: C25H26N2O6 MolecularWeight: 450.48374

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C(C(=C(C1=O)[O-])C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=CC=C4OC

Isomeric SMILES

C[NH+](C)CCN1C(C(=C(C1=O)[O-])C(=O)C2=CC3=C(O2)C(=CC=C3)OC)C4=CC=CC=C4OC

InChI

InChI=1S/C25H26N2O6/c1-26(2)12-13-27-21(16-9-5-6-10-17(16)31-3)20(23(29)25(27)30)22(28)19-14-15-8-7-11-18(32-4)24(15)33-19/h5-11,14,21,29H,12-13H2,1-4H3