ethyl 5-[2-(butylamino)-2-oxidanylidene-ethanoyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 5-[2-(butylamino)-2-oxidanylidene-ethanoyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(butylamino)-2-oxo-acetyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 5-[2-(butylamino)-1,2-dioxoethyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[2-(butylamino)-2-oxoacetyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(butylamino)-2-keto-acetyl]-4-(3,4-dimethoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C22H28N2O6 MolecularWeight: 416.46752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CCCCNC(=O)C(=O)C1=C(C(=C(N1)C)C(=O)OCC)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H28N2O6/c1-6-8-11-23-21(26)20(25)19-18(17(13(3)24-19)22(27)30-7-2)14-9-10-15(28-4)16(12-14)29-5/h9-10,12,24H,6-8,11H2,1-5H3,(H,23,26)