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

Systemtic Name: ethyl 1-[4-ethyl-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrol-2-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[4-ethyl-3,5-dimethyl-1-(p-tolylmethyl)pyrrole-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[4-ethyl-3,5-dimethyl-1-[(4-methylphenyl)methyl]-2-pyrrolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-ethyl-3,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrole-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[4-ethyl-3,5-dimethyl-1-(4-methylbenzyl)pyrrole-2-carbonyl]isonipecotic acid ethyl ester Formula: C25H34N2O3 MolecularWeight: 410.54906

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(N(C(=C1C)C(=O)N2CCC(CC2)C(=O)OCC)CC3=CC=C(C=C3)C)C

Isomeric SMILES

CCC1=C(N(C(=C1C)C(=O)N2CCC(CC2)C(=O)OCC)CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C25H34N2O3/c1-6-22-18(4)23(27(19(22)5)16-20-10-8-17(3)9-11-20)24(28)26-14-12-21(13-15-26)25(29)30-7-2/h8-11,21H,6-7,12-16H2,1-5H3