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

Systemtic Name: ethyl 4-(2,5-dimethoxyphenyl)-2-methyl-5-[2-oxidanylidene-2-(3-oxidanylpropylamino)ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(2,5-dimethoxyphenyl)-5-[2-(3-hydroxypropylamino)-2-oxo-acetyl]-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-(2,5-dimethoxyphenyl)-5-[2-(3-hydroxypropylamino)-1,2-dioxoethyl]-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2,5-dimethoxyphenyl)-5-[2-(3-hydroxypropylamino)-2-oxoacetyl]-2-methyl-1H-pyrrole-3-carboxylate Traditional Name: 4-(2,5-dimethoxyphenyl)-5-[2-(3-hydroxypropylamino)-2-keto-acetyl]-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H26N2O7 MolecularWeight: 418.44034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=C(C=CC(=C2)OC)OC)C(=O)C(=O)NCCCO)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=C(C=CC(=C2)OC)OC)C(=O)C(=O)NCCCO)C

InChI

InChI=1S/C21H26N2O7/c1-5-30-21(27)16-12(2)23-18(19(25)20(26)22-9-6-10-24)17(16)14-11-13(28-3)7-8-15(14)29-4/h7-8,11,23-24H,5-6,9-10H2,1-4H3,(H,22,26)