ethyl 4-[[5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl]carbonyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl]carbonyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[5-(4-fluorophenyl)-2-methyl-1H-pyrrole-3-carbonyl]piperazine-1-carboxylic acid ethyl ester Formula: C19H22FN3O3 MolecularWeight: 359.394683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=C(NC(=C2)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=C(NC(=C2)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C19H22FN3O3/c1-3-26-19(25)23-10-8-22(9-11-23)18(24)16-12-17(21-13(16)2)14-4-6-15(20)7-5-14/h4-7,12,21H,3,8-11H2,1-2H3