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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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