1-[[3,5-bis(bromanyl)-4-(dimethylamino)phenyl]methyl]piperidine-4-carboxylic acid

Systemtic Name: 1-[[3,5-bis(bromanyl)-4-(dimethylamino)phenyl]methyl]piperidine-4-carboxylic acid Openeye Name: 1-[[3,5-dibromo-4-(dimethylamino)phenyl]methyl]piperidine-4-carboxylic acid CAS Name: 1-[[3,5-dibromo-4-(dimethylamino)phenyl]methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-[[3,5-dibromo-4-(dimethylamino)phenyl]methyl]piperidine-4-carboxylic acid Traditional Name: 1-[3,5-dibromo-4-(dimethylamino)benzyl]isonipecotic acid Formula: C15H20Br2N2O2 MolecularWeight: 420.1395

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1Br)CN2CCC(CC2)C(=O)O)Br

Isomeric SMILES

CN(C)C1=C(C=C(C=C1Br)CN2CCC(CC2)C(=O)O)Br

InChI

InChI=1S/C15H20Br2N2O2/c1-18(2)14-12(16)7-10(8-13(14)17)9-19-5-3-11(4-6-19)15(20)21/h7-8,11H,3-6,9H2,1-2H3,(H,20,21)