5-[2-acetyloxyethyl-(diethanoylamino)carbamoyl]-2,3-bis(iodanyl)benzoic acid

Systemtic Name: 5-[2-acetyloxyethyl-(diethanoylamino)carbamoyl]-2,3-bis(iodanyl)benzoic acid Openeye Name: 5-[2-acetoxyethyl-(diacetylamino)carbamoyl]-2,3-diiodo-benzoic acid CAS Name: 5-[[2-acetyloxyethyl-(diacetylamino)amino]-oxomethyl]-2,3-diiodobenzoic acid IUPAC Name: 5-[2-acetyloxyethyl-(diacetylamino)carbamoyl]-2,3-diiodobenzoic acid Traditional Name: 5-[2-acetoxyethyl-(diacetylamino)carbamoyl]-2,3-diiodo-benzoic acid Formula: C16H16I2N2O7 MolecularWeight: 602.11638

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16I2N2O7/c1-8(21)20(9(2)22)19(4-5-27-10(3)23)15(24)11-6-12(16(25)26)14(18)13(17)7-11/h6-7H,4-5H2,1-3H3,(H,25,26)