2-azanyl-3-(4-iodanyl-4-oxidanyl-cyclohexa-2,5-dien-1-yl)propanoic acid

Systemtic Name: 2-azanyl-3-(4-iodanyl-4-oxidanyl-cyclohexa-2,5-dien-1-yl)propanoic acid Openeye Name: 2-amino-3-(4-hydroxy-4-iodo-cyclohexa-2,5-dien-1-yl)propanoic acid CAS Name: 2-amino-3-(4-hydroxy-4-iodo-1-cyclohexa-2,5-dienyl)propanoic acid IUPAC Name: 2-amino-3-(4-hydroxy-4-iodocyclohexa-2,5-dien-1-yl)propanoic acid Traditional Name: 2-amino-3-(4-hydroxy-4-iodo-cyclohexa-2,5-dien-1-yl)propionic acid Formula: C9H12INO3 MolecularWeight: 309.10095

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C=CC1CC(C(=O)O)N)(O)I

Isomeric SMILES

C1=CC(C=CC1CC(C(=O)O)N)(O)I

InChI

InChI=1S/C9H12INO3/c10-9(14)3-1-6(2-4-9)5-7(11)8(12)13/h1-4,6-7,14H,5,11H2,(H,12,13)