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

Systemtic Name: ethyl 1-[2-(4-bromanyl-2-methyl-phenoxy)ethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-bromo-2-methyl-phenoxy)acetyl]piperidine-4-carboxylate CAS Name: 1-[2-(4-bromo-2-methylphenoxy)-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-bromo-2-methylphenoxy)acetyl]piperidine-4-carboxylate Traditional Name: 1-[2-(4-bromo-2-methyl-phenoxy)acetyl]isonipecotic acid ethyl ester Formula: C17H22BrNO4 MolecularWeight: 384.26488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22BrNO4/c1-3-22-17(21)13-6-8-19(9-7-13)16(20)11-23-15-5-4-14(18)10-12(15)2/h4-5,10,13H,3,6-9,11H2,1-2H3