ethyl 1-[4-ethanoyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrrol-2-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-ethanoyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrrol-2-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-pyrrole-2-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethyl-2-pyrrolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-acetyl-1-[(4-fluorophenyl)methyl]-3,5-dimethylpyrrole-2-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[4-acetyl-1-(4-fluorobenzyl)-3,5-dimethyl-pyrrole-2-carbonyl]nipecotic acid ethyl ester Formula: C24H29FN2O4 MolecularWeight: 428.496463

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C(=C(N2CC3=CC=C(C=C3)F)C)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(C(=C(N2CC3=CC=C(C=C3)F)C)C(=O)C)C

InChI

InChI=1S/C24H29FN2O4/c1-5-31-24(30)19-7-6-12-26(14-19)23(29)22-15(2)21(17(4)28)16(3)27(22)13-18-8-10-20(25)11-9-18/h8-11,19H,5-7,12-14H2,1-4H3