1-[[4-bromanyl-2,6-bis(chloranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[[4-bromanyl-2,6-bis(chloranyl)phenyl]carbamoyl]piperidine-3-carboxylic acid Openeye Name: 1-[(4-bromo-2,6-dichloro-phenyl)carbamoyl]piperidine-3-carboxylic acid CAS Name: 1-[(4-bromo-2,6-dichloroanilino)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(4-bromo-2,6-dichlorophenyl)carbamoyl]piperidine-3-carboxylic acid Traditional Name: 1-[(4-bromo-2,6-dichloro-phenyl)carbamoyl]nipecotic acid Formula: C13H13BrCl2N2O3 MolecularWeight: 396.06392

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)NC2=C(C=C(C=C2Cl)Br)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)NC2=C(C=C(C=C2Cl)Br)Cl)C(=O)O

InChI

InChI=1S/C13H13BrCl2N2O3/c14-8-4-9(15)11(10(16)5-8)17-13(21)18-3-1-2-7(6-18)12(19)20/h4-5,7H,1-3,6H2,(H,17,21)(H,19,20)