methyl 1-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(4-bromanyl-3,5-dimethoxy-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(4-bromo-3,5-dimethoxy-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-bromo-3,5-dimethoxybenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-bromo-3,5-dimethoxy-benzoyl)isonipecotic acid methyl ester Formula: C16H20BrNO5 MolecularWeight: 386.2377

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)N2CCC(CC2)C(=O)OC

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)N2CCC(CC2)C(=O)OC

InChI

InChI=1S/C16H20BrNO5/c1-21-12-8-11(9-13(22-2)14(12)17)15(19)18-6-4-10(5-7-18)16(20)23-3/h8-10H,4-7H2,1-3H3