1-(2-bromanyl-5-methoxy-phenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(2-bromanyl-5-methoxy-phenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(2-bromo-5-methoxy-benzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(2-bromo-5-methoxyphenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(2-bromo-5-methoxybenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(2-bromo-5-methoxy-benzoyl)isonipecotic acid Formula: C14H16BrNO4 MolecularWeight: 342.18514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C14H16BrNO4/c1-20-10-2-3-12(15)11(8-10)13(17)16-6-4-9(5-7-16)14(18)19/h2-3,8-9H,4-7H2,1H3,(H,18,19)