methyl 1-[4-(3-bromanylphenoxy)butanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[4-(3-bromanylphenoxy)butanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[4-(3-bromophenoxy)butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-(3-bromophenoxy)-1-oxobutyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[4-(3-bromophenoxy)butanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-(3-bromophenoxy)butanoyl]isonipecotic acid methyl ester Formula: C17H22BrNO4 MolecularWeight: 384.26488

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)CCCOC2=CC(=CC=C2)Br

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)CCCOC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H22BrNO4/c1-22-17(21)13-7-9-19(10-8-13)16(20)6-3-11-23-15-5-2-4-14(18)12-15/h2,4-5,12-13H,3,6-11H2,1H3