ethyl 4-[[(4-fluorophenyl)-(2-methylpropanoyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[[(4-fluorophenyl)-(2-methylpropanoyl)amino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Openeye Name: ethyl 4-[[4-fluoro-N-(2-methylpropanoyl)anilino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate CAS Name: 4-[(4-fluoro-N-(2-methyl-1-oxopropyl)anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-fluoro-N-(2-methylpropanoyl)anilino]methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylate Traditional Name: 4-[(4-fluoro-N-isobutyryl-anilino)methyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Formula: C20H25FN2O3 MolecularWeight: 360.422503

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C)CN(C2=CC=C(C=C2)F)C(=O)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)C)CN(C2=CC=C(C=C2)F)C(=O)C(C)C)C

InChI

InChI=1S/C20H25FN2O3/c1-6-26-20(25)18-13(4)17(14(5)22-18)11-23(19(24)12(2)3)16-9-7-15(21)8-10-16/h7-10,12,22H,6,11H2,1-5H3