tert-butyl 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylate

Systemtic Name: tert-butyl 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylate Openeye Name: tert-butyl 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylate CAS Name: 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylate Traditional Name: 3-(2-fluorophenyl)-4-methyl-1H-pyrrole-2-carboxylic acid tert-butyl ester Formula: C16H18FNO2 MolecularWeight: 275.318023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CNC(=C1C2=CC=CC=C2F)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CNC(=C1C2=CC=CC=C2F)C(=O)OC(C)(C)C

InChI

InChI=1S/C16H18FNO2/c1-10-9-18-14(15(19)20-16(2,3)4)13(10)11-7-5-6-8-12(11)17/h5-9,18H,1-4H3