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

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

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)C(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

Isomeric SMILES

C(CCl)C(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)O)I

InChI

InChI=1S/C11H7ClI3NO5/c12-2-1-3(17)16-9-7(14)4(10(18)19)6(13)5(8(9)15)11(20)21/h1-2H2,(H,16,17)(H,18,19)(H,20,21)