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

Systemtic Name: 1-[1-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxylic acid Openeye Name: 1-[1-(2-bromo-4,5-dimethoxy-phenyl)ethyl]piperidine-4-carboxylic acid CAS Name: 1-[1-(2-bromo-4,5-dimethoxyphenyl)ethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[1-(2-bromo-4,5-dimethoxyphenyl)ethyl]piperidine-4-carboxylic acid Traditional Name: 1-[1-(2-bromo-4,5-dimethoxy-phenyl)ethyl]isonipecotic acid Formula: C16H22BrNO4 MolecularWeight: 372.25418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22BrNO4/c1-10(18-6-4-11(5-7-18)16(19)20)12-8-14(21-2)15(22-3)9-13(12)17/h8-11H,4-7H2,1-3H3,(H,19,20)