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

Systemtic Name: ethyl 4-(2-fluorophenyl)-2-methyl-5-[2-(2-methylpropylamino)-2-oxidanylidene-ethanoyl]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 4-(2-fluorophenyl)-5-[2-(isobutylamino)-2-oxo-acetyl]-2-methyl-1H-pyrrole-3-carboxylate CAS Name: 4-(2-fluorophenyl)-2-methyl-5-[2-(2-methylpropylamino)-1,2-dioxoethyl]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-fluorophenyl)-2-methyl-5-[2-(2-methylpropylamino)-2-oxoacetyl]-1H-pyrrole-3-carboxylate Traditional Name: 4-(2-fluorophenyl)-5-[2-(isobutylamino)-2-keto-acetyl]-2-methyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C20H23FN2O4 MolecularWeight: 374.406023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2F)C(=O)C(=O)NCC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1C2=CC=CC=C2F)C(=O)C(=O)NCC(C)C)C

InChI

InChI=1S/C20H23FN2O4/c1-5-27-20(26)15-12(4)23-17(18(24)19(25)22-10-11(2)3)16(15)13-8-6-7-9-14(13)21/h6-9,11,23H,5,10H2,1-4H3,(H,22,25)