ethyl 1-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-bromanyl-3,5-dimethyl-phenoxy)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-bromo-3,5-dimethylphenoxy)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-bromo-3,5-dimethylphenoxy)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-bromo-3,5-dimethyl-phenoxy)acetyl]isonipecotic acid ethyl ester Formula: C18H24BrNO4 MolecularWeight: 398.29146

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24BrNO4/c1-4-23-18(22)14-5-7-20(8-6-14)16(21)11-24-15-9-12(2)17(19)13(3)10-15/h9-10,14H,4-8,11H2,1-3H3