[(1R)-1-(4-fluorophenyl)ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate

Systemtic Name: [(1R)-1-(4-fluorophenyl)ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate Openeye Name: [(1R)-1-(4-fluorophenyl)ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate CAS Name: 4-(2,5-dimethyl-1-pyrrolyl)benzoic acid [(1R)-1-(4-fluorophenyl)ethyl] ester IUPAC Name: [(1R)-1-(4-fluorophenyl)ethyl] 4-(2,5-dimethylpyrrol-1-yl)benzoate Traditional Name: 4-(2,5-dimethylpyrrol-1-yl)benzoic acid [(1R)-1-(4-fluorophenyl)ethyl] ester Formula: C21H20FNO2 MolecularWeight: 337.387403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)OC(C)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)C(=O)O[C@H](C)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H20FNO2/c1-14-4-5-15(2)23(14)20-12-8-18(9-13-20)21(24)25-16(3)17-6-10-19(22)11-7-17/h4-13,16H,1-3H3/t16-/m1/s1