ethyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylate CAS Name: 2-[4-(3-chlorophenyl)-1-piperazinyl]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(3-chlorophenyl)piperazin-1-yl]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylate Traditional Name: 2-[4-(3-chlorophenyl)piperazino]-5-(4-fluorophenyl)-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C23H23ClFN3O2 MolecularWeight: 427.899023

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1)C2=CC=C(C=C2)F)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1)C2=CC=C(C=C2)F)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H23ClFN3O2/c1-2-30-23(29)20-15-21(16-6-8-18(25)9-7-16)26-22(20)28-12-10-27(11-13-28)19-5-3-4-17(24)14-19/h3-9,14-15,26H,2,10-13H2,1H3