[2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 4-methyl-3-pyrrol-1-yl-benzoate

Systemtic Name: [2-oxidanylidene-2-[2,2,2-tris(fluoranyl)ethylamino]ethyl] 4-methyl-3-pyrrol-1-yl-benzoate Openeye Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 4-methyl-3-pyrrol-1-yl-benzoate CAS Name: 4-methyl-3-(1-pyrrolyl)benzoic acid [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2,2,2-trifluoroethylamino)ethyl] 4-methyl-3-pyrrol-1-ylbenzoate Traditional Name: 4-methyl-3-pyrrol-1-yl-benzoic acid [2-keto-2-(2,2,2-trifluoroethylamino)ethyl] ester Formula: C16H15F3N2O3 MolecularWeight: 340.29711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC(F)(F)F)N2C=CC=C2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCC(=O)NCC(F)(F)F)N2C=CC=C2

InChI

InChI=1S/C16H15F3N2O3/c1-11-4-5-12(8-13(11)21-6-2-3-7-21)15(23)24-9-14(22)20-10-16(17,18)19/h2-8H,9-10H2,1H3,(H,20,22)