methyl 3-[[5-iodanyl-2-(methylamino)phenyl]carbonylamino]-2-methyl-propanoate

Systemtic Name: methyl 3-[[5-iodanyl-2-(methylamino)phenyl]carbonylamino]-2-methyl-propanoate Openeye Name: methyl 3-[[5-iodo-2-(methylamino)benzoyl]amino]-2-methyl-propanoate CAS Name: 3-[[[5-iodo-2-(methylamino)phenyl]-oxomethyl]amino]-2-methylpropanoic acid methyl ester IUPAC Name: methyl 3-[[5-iodo-2-(methylamino)benzoyl]amino]-2-methylpropanoate Traditional Name: 3-[[5-iodo-2-(methylamino)benzoyl]amino]-2-methyl-propionic acid methyl ester Formula: C13H17IN2O3 MolecularWeight: 376.19015

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=C(C=CC(=C1)I)NC)C(=O)OC

Isomeric SMILES

CC(CNC(=O)C1=C(C=CC(=C1)I)NC)C(=O)OC

InChI

InChI=1S/C13H17IN2O3/c1-8(13(18)19-3)7-16-12(17)10-6-9(14)4-5-11(10)15-2/h4-6,8,15H,7H2,1-3H3,(H,16,17)