2-azanyl-3-(4-iodanylbutanoyloxy)benzoic acid

Systemtic Name: 2-azanyl-3-(4-iodanylbutanoyloxy)benzoic acid Openeye Name: 2-amino-3-(4-iodobutanoyloxy)benzoic acid CAS Name: 2-amino-3-(4-iodo-1-oxobutoxy)benzoic acid IUPAC Name: 2-amino-3-(4-iodobutanoyloxy)benzoic acid Traditional Name: 2-amino-3-(4-iodobutanoyloxy)benzoic acid Formula: C11H12INO4 MolecularWeight: 349.12175

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)OC(=O)CCCI)N)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)OC(=O)CCCI)N)C(=O)O

InChI

InChI=1S/C11H12INO4/c12-6-2-5-9(14)17-8-4-1-3-7(10(8)13)11(15)16/h1,3-4H,2,5-6,13H2,(H,15,16)