2-(3-iodanyl-4-oxidanyl-phenyl)-2-piperidin-2-yl-ethanoic acid

Systemtic Name: 2-(3-iodanyl-4-oxidanyl-phenyl)-2-piperidin-2-yl-ethanoic acid Openeye Name: 2-(4-hydroxy-3-iodo-phenyl)-2-(2-piperidyl)acetic acid CAS Name: 2-(4-hydroxy-3-iodophenyl)-2-(2-piperidinyl)acetic acid IUPAC Name: 2-(4-hydroxy-3-iodophenyl)-2-piperidin-2-ylacetic acid Traditional Name: 2-(4-hydroxy-3-iodo-phenyl)-2-(2-piperidyl)acetic acid Formula: C13H16INO3 MolecularWeight: 361.17551

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(C1)C(C2=CC(=C(C=C2)O)I)C(=O)O

Isomeric SMILES

C1CCNC(C1)C(C2=CC(=C(C=C2)O)I)C(=O)O

InChI

InChI=1S/C13H16INO3/c14-9-7-8(4-5-11(9)16)12(13(17)18)10-3-1-2-6-15-10/h4-5,7,10,12,15-16H,1-3,6H2,(H,17,18)