ethyl 2-methyl-4-(4-methylphenyl)-5-[2-(2-methylpropylamino)-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-(2-methylpropylamino)-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(isobutylamino)-2-oxo-acetyl]-2-methyl-4-(p-tolyl)-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-4-(4-methylphenyl)-5-[2-(2-methylpropylamino)-1,2-dioxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-(4-methylphenyl)-5-[2-(2-methylpropylamino)-2-oxoacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(isobutylamino)-2-keto-acetyl]-2-methyl-4-(p-tolyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C)C(=O)C(=O)NCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=C(C=C2)C)C(=O)C(=O)NCC(C)C)C

InChI

InChI=1S/C21H26N2O4/c1-6-27-21(26)16-14(5)23-18(19(24)20(25)22-11-12(2)3)17(16)15-9-7-13(4)8-10-15/h7-10,12,23H,6,11H2,1-5H3,(H,22,25)