1-[1-(2-bromanyl-4,5-dimethoxy-phenyl)pentyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[1-(2-bromanyl-4,5-dimethoxy-phenyl)pentyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(2-bromo-4,5-dimethoxy-phenyl)pentyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(2-bromo-4,5-dimethoxyphenyl)pentyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(2-bromo-4,5-dimethoxyphenyl)pentyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(2-bromo-4,5-dimethoxy-phenyl)pentyl]isonipecotic acid Formula: C19H28BrNO4 MolecularWeight: 414.33392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C(C=C1Br)OC)OC)N2CCC(CC2)C(=O)O

Isomeric SMILES

CCCCC(C1=CC(=C(C=C1Br)OC)OC)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C19H28BrNO4/c1-4-5-6-16(21-9-7-13(8-10-21)19(22)23)14-11-17(24-2)18(25-3)12-15(14)20/h11-13,16H,4-10H2,1-3H3,(H,22,23)