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

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C20H25FN2O3 MolecularWeight: 360.422503

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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