ethyl 1-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-methyl-3-pyrrol-1-yl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-methyl-3-pyrrol-1-yl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[[4-methyl-3-(1-pyrrolyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-methyl-3-pyrrol-1-ylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-methyl-3-pyrrol-1-yl-benzoyl)isonipecotic acid ethyl ester Formula: C20H24N2O3 MolecularWeight: 340.41616

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)N3C=CC=C3

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)N3C=CC=C3

InChI

InChI=1S/C20H24N2O3/c1-3-25-20(24)16-8-12-22(13-9-16)19(23)17-7-6-15(2)18(14-17)21-10-4-5-11-21/h4-7,10-11,14,16H,3,8-9,12-13H2,1-2H3