1-cyanoethyl 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: 1-cyanoethyl 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: 1-cyanoethyl 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-(4-fluorophenyl)-2,5-dimethyl-3-pyrrolecarboxylic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-(4-fluorophenyl)-2,5-dimethyl-pyrrole-3-carboxylic acid 1-cyanoethyl ester Formula: C16H15FN2O2 MolecularWeight: 286.300903

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)OC(C)C#N

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)F)C)C(=O)OC(C)C#N

InChI

InChI=1S/C16H15FN2O2/c1-10-8-15(16(20)21-11(2)9-18)12(3)19(10)14-6-4-13(17)5-7-14/h4-8,11H,1-3H3