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

Systemtic Name: ethyl 1-[1-(4-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(4-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(4-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-3-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-fluorophenyl)-5-(3-methoxyphenyl)-2-methylpyrrole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(4-fluorophenyl)-5-(3-methoxyphenyl)-2-methyl-pyrrole-3-carbonyl]isonipecotic acid ethyl ester Formula: C27H29FN2O4 MolecularWeight: 464.528563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)F)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(C(=C2)C3=CC(=CC=C3)OC)C4=CC=C(C=C4)F)C

InChI

InChI=1S/C27H29FN2O4/c1-4-34-27(32)19-12-14-29(15-13-19)26(31)24-17-25(20-6-5-7-23(16-20)33-3)30(18(24)2)22-10-8-21(28)9-11-22/h5-11,16-17,19H,4,12-15H2,1-3H3