1-[3,5-bis(chloranyl)-2-iodanyl-phenyl]carbonylpiperidine-3-carboxylic acid

Systemtic Name: 1-[3,5-bis(chloranyl)-2-iodanyl-phenyl]carbonylpiperidine-3-carboxylic acid Openeye Name: 1-(3,5-dichloro-2-iodo-benzoyl)piperidine-3-carboxylic acid CAS Name: 1-[(3,5-dichloro-2-iodophenyl)-oxomethyl]-3-piperidinecarboxylic acid IUPAC Name: 1-(3,5-dichloro-2-iodobenzoyl)piperidine-3-carboxylic acid Traditional Name: 1-(3,5-dichloro-2-iodo-benzoyl)nipecotic acid Formula: C13H12Cl2INO3 MolecularWeight: 428.04975

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC(=CC(=C2I)Cl)Cl)C(=O)O

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC(=CC(=C2I)Cl)Cl)C(=O)O

InChI

InChI=1S/C13H12Cl2INO3/c14-8-4-9(11(16)10(15)5-8)12(18)17-3-1-2-7(6-17)13(19)20/h4-5,7H,1-3,6H2,(H,19,20)