[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-iodanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-iodanylbenzoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C13H15IN2O4 MolecularWeight: 390.17367

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15IN2O4/c1-8(2)15-13(19)16-11(17)7-20-12(18)9-4-3-5-10(14)6-9/h3-6,8H,7H2,1-2H3,(H2,15,16,17,19)