(phenylmethyl) 3-[[4-iodanyl-2-(methylamino)phenyl]carbonylamino]propanoate

Systemtic Name: (phenylmethyl) 3-[[4-iodanyl-2-(methylamino)phenyl]carbonylamino]propanoate Openeye Name: benzyl 3-[[4-iodo-2-(methylamino)benzoyl]amino]propanoate CAS Name: 3-[[[4-iodo-2-(methylamino)phenyl]-oxomethyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[[4-iodo-2-(methylamino)benzoyl]amino]propanoate Traditional Name: 3-[[4-iodo-2-(methylamino)benzoyl]amino]propionic acid benzyl ester Formula: C18H19IN2O3 MolecularWeight: 438.25953

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)I)C(=O)NCCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CNC1=C(C=CC(=C1)I)C(=O)NCCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H19IN2O3/c1-20-16-11-14(19)7-8-15(16)18(23)21-10-9-17(22)24-12-13-5-3-2-4-6-13/h2-8,11,20H,9-10,12H2,1H3,(H,21,23)