ethyl 1-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2-bromanyl-4-tert-butyl-phenoxy)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(2-bromo-4-tert-butylphenoxy)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2-bromo-4-tert-butylphenoxy)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2-bromo-4-tert-butyl-phenoxy)acetyl]isonipecotic acid ethyl ester Formula: C20H28BrNO4 MolecularWeight: 426.34462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)COC2=C(C=C(C=C2)C(C)(C)C)Br

InChI

InChI=1S/C20H28BrNO4/c1-5-25-19(24)14-8-10-22(11-9-14)18(23)13-26-17-7-6-15(12-16(17)21)20(2,3)4/h6-7,12,14H,5,8-11,13H2,1-4H3