5-(2-chloranylpropanoylamino)-2,4,6-tris(iodanyl)benzene-1,3-dicarboxylic acid

Systemtic Name: 5-(2-chloranylpropanoylamino)-2,4,6-tris(iodanyl)benzene-1,3-dicarboxylic acid Openeye Name: 5-(2-chloropropanoylamino)-2,4,6-triiodo-benzene-1,3-dicarboxylic acid CAS Name: 5-[(2-chloro-1-oxopropyl)amino]-2,4,6-triiodobenzene-1,3-dicarboxylic acid IUPAC Name: 5-(2-chloropropanoylamino)-2,4,6-triiodobenzene-1,3-dicarboxylic acid Traditional Name: 5-(2-chloropropanoylamino)-2,4,6-triiodo-isophthalic acid Formula: C11H7ClI3NO5 MolecularWeight: 649.34339

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I)Cl

Isomeric SMILES

CC(C(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I)Cl

InChI

InChI=1S/C11H7ClI3NO5/c1-2(12)9(17)16-8-6(14)3(10(18)19)5(13)4(7(8)15)11(20)21/h2H,1H3,(H,16,17)(H,18,19)(H,20,21)