1-[(2-iodanylphenyl)methyl]piperidine-3-carboxylic acid

Systemtic Name: 1-[(2-iodanylphenyl)methyl]piperidine-3-carboxylic acid Openeye Name: 1-[(2-iodophenyl)methyl]piperidine-3-carboxylic acid CAS Name: 1-[(2-iodophenyl)methyl]-3-piperidinecarboxylic acid IUPAC Name: 1-[(2-iodophenyl)methyl]piperidine-3-carboxylic acid Traditional Name: 1-(2-iodobenzyl)nipecotic acid Formula: C13H16INO2 MolecularWeight: 345.17611

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CC=CC=C2I)C(=O)O

Isomeric SMILES

C1CC(CN(C1)CC2=CC=CC=C2I)C(=O)O

InChI

InChI=1S/C13H16INO2/c14-12-6-2-1-4-10(12)8-15-7-3-5-11(9-15)13(16)17/h1-2,4,6,11H,3,5,7-9H2,(H,16,17)