2-ethyl-1-[5-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-1H-pyrrol-3-yl]butan-1-one

Systemtic Name: 2-ethyl-1-[5-[4-(2-fluorophenyl)piperazin-1-yl]carbonyl-1H-pyrrol-3-yl]butan-1-one Openeye Name: 2-ethyl-1-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]butan-1-one CAS Name: 2-ethyl-1-[5-[[4-(2-fluorophenyl)-1-piperazinyl]-oxomethyl]-1H-pyrrol-3-yl]-1-butanone IUPAC Name: 2-ethyl-1-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]butan-1-one Traditional Name: 2-ethyl-1-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]butan-1-one Formula: C21H26FN3O2 MolecularWeight: 371.448443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)C1=CNC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CCC(CC)C(=O)C1=CNC(=C1)C(=O)N2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C21H26FN3O2/c1-3-15(4-2)20(26)16-13-18(23-14-16)21(27)25-11-9-24(10-12-25)19-8-6-5-7-17(19)22/h5-8,13-15,23H,3-4,9-12H2,1-2H3