[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-azanyl-5-iodanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 2-azanyl-5-iodanyl-benzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 2-amino-5-iodo-benzoate CAS Name: 2-amino-5-iodobenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 2-amino-5-iodobenzoate Traditional Name: 2-amino-5-iodo-benzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H16IN3O4 MolecularWeight: 405.18831

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)I)N

Isomeric SMILES

CC(C)NC(=O)NC(=O)COC(=O)C1=C(C=CC(=C1)I)N

InChI

InChI=1S/C13H16IN3O4/c1-7(2)16-13(20)17-11(18)6-21-12(19)9-5-8(14)3-4-10(9)15/h3-5,7H,6,15H2,1-2H3,(H2,16,17,18,20)