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

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-(2-methylpropylamino)-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-[2-(isobutylamino)-2-oxo-acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-methyl-5-[2-(2-methylpropylamino)-1,2-dioxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-methyl-5-[2-(2-methylpropylamino)-2-oxoacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 5-[2-(isobutylamino)-2-keto-acetyl]-4-(4-methoxyphenyl)-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O5/c1-6-28-21(26)16-13(4)23-18(19(24)20(25)22-11-12(2)3)17(16)14-7-9-15(27-5)10-8-14/h7-10,12,23H,6,11H2,1-5H3,(H,22,25)