ethyl 1-(4-ethyl-3,5-dimethyl-1-prop-2-enyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(4-ethyl-3,5-dimethyl-1-prop-2-enyl-pyrrol-2-yl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(1-allyl-4-ethyl-3,5-dimethyl-pyrrole-2-carbonyl)piperidine-4-carboxylate CAS Name: 1-[(4-ethyl-3,5-dimethyl-1-prop-2-enyl-2-pyrrolyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-ethyl-3,5-dimethyl-1-prop-2-enylpyrrole-2-carbonyl)piperidine-4-carboxylate Traditional Name: 1-(1-allyl-4-ethyl-3,5-dimethyl-pyrrole-2-carbonyl)isonipecotic acid ethyl ester Formula: C20H30N2O3 MolecularWeight: 346.4638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H30N2O3/c1-6-11-22-15(5)17(7-2)14(4)18(22)19(23)21-12-9-16(10-13-21)20(24)25-8-3/h6,16H,1,7-13H2,2-5H3