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

Systemtic Name: ethyl 1-[1-[(2-fluorophenyl)methyl]-3,4,5-trimethyl-pyrrol-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-[(2-fluorophenyl)methyl]-3,4,5-trimethyl-pyrrole-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-[(2-fluorophenyl)methyl]-3,4,5-trimethyl-2-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-[(2-fluorophenyl)methyl]-3,4,5-trimethylpyrrole-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(2-fluorobenzyl)-3,4,5-trimethyl-pyrrole-2-carbonyl]isonipecotic acid ethyl ester Formula: C23H29FN2O3 MolecularWeight: 400.486363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C(=C(N2CC3=CC=CC=C3F)C)C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C(=C(N2CC3=CC=CC=C3F)C)C)C

InChI

InChI=1S/C23H29FN2O3/c1-5-29-23(28)18-10-12-25(13-11-18)22(27)21-16(3)15(2)17(4)26(21)14-19-8-6-7-9-20(19)24/h6-9,18H,5,10-14H2,1-4H3