[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C19H23FN2O3 MolecularWeight: 346.395923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)F)C

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=C(N(C(=C1)C)C2=CC=C(C=C2)F)C

InChI

InChI=1S/C19H23FN2O3/c1-5-12(2)21-18(23)11-25-19(24)17-10-13(3)22(14(17)4)16-8-6-15(20)7-9-16/h6-10,12H,5,11H2,1-4H3,(H,21,23)