2-methoxyethyl 5-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate

Systemtic Name: 2-methoxyethyl 5-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonyl-2,4-dimethyl-1H-pyrrole-3-carboxylate Openeye Name: 2-methoxyethyl 5-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 5-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]-2,4-dimethyl-1H-pyrrole-3-carboxylic acid 2-methoxyethyl ester Formula: C22H25ClFN3O5 MolecularWeight: 465.902403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OCCOC)C)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CC1=C(NC(=C1C(=O)OCCOC)C)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C22H25ClFN3O5/c1-13-18(22(30)32-11-10-31-3)14(2)25-19(13)21(29)27-8-6-26(7-9-27)20(28)16-12-15(23)4-5-17(16)24/h4-5,12,25H,6-11H2,1-3H3