ethyl 4-[2-cyano-3-(2,4-dimethoxyphenyl)-3-oxidanylidene-propanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-[2-cyano-3-(2,4-dimethoxyphenyl)-3-oxidanylidene-propanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-[2-cyano-3-(2,4-dimethoxyphenyl)-3-oxo-propanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 4-[2-cyano-3-(2,4-dimethoxyphenyl)-1,3-dioxopropyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-cyano-3-(2,4-dimethoxyphenyl)-3-oxopropanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 4-[2-cyano-3-(2,4-dimethoxyphenyl)-3-keto-propanoyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C(=O)C(C#N)C(=O)C2=C(C=C(C=C2)OC)OC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C(=O)C(C#N)C(=O)C2=C(C=C(C=C2)OC)OC)C)C

InChI

InChI=1S/C21H22N2O6/c1-6-29-21(26)18-12(3)23-11(2)17(18)20(25)15(10-22)19(24)14-8-7-13(27-4)9-16(14)28-5/h7-9,15,23H,6H2,1-5H3