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

Systemtic Name: 1-[2-(dimethylazaniumyl)ethyl]-3-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-2-(4-methylphenyl)-5-oxidanylidene-2H-pyrrol-4-olate Openeye Name: 1-[2-(dimethylammonio)ethyl]-3-(7-methoxybenzofuran-2-carbonyl)-5-oxo-2-(p-tolyl)-2H-pyrrol-4-olate CAS Name: 1-[2-(dimethylammonio)ethyl]-3-[(7-methoxy-2-benzofuranyl)-oxomethyl]-2-(4-methylphenyl)-5-oxo-2H-pyrrol-4-olate IUPAC Name: 1-[2-(dimethylazaniumyl)ethyl]-3-(7-methoxy-1-benzofuran-2-carbonyl)-2-(4-methylphenyl)-5-oxo-2H-pyrrol-4-olate Traditional Name: 1-[2-(dimethylammonio)ethyl]-2-keto-4-(7-methoxybenzofuran-2-carbonyl)-5-(p-tolyl)-3-pyrrolin-3-olate Formula: C25H26N2O5 MolecularWeight: 434.48434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CC[NH+](C)C)[O-])C(=O)C3=CC4=C(O3)C(=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2C(=C(C(=O)N2CC[NH+](C)C)[O-])C(=O)C3=CC4=C(O3)C(=CC=C4)OC

InChI

InChI=1S/C25H26N2O5/c1-15-8-10-16(11-9-15)21-20(23(29)25(30)27(21)13-12-26(2)3)22(28)19-14-17-6-5-7-18(31-4)24(17)32-19/h5-11,14,21,29H,12-13H2,1-4H3