methyl (2S)-2-[2-[(2-iodanylphenyl)carbonylamino]ethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[2-[(2-iodanylphenyl)carbonylamino]ethanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[[2-[(2-iodobenzoyl)amino]acetyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[2-[[(2-iodophenyl)-oxomethyl]amino]-1-oxoethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[[2-[(2-iodobenzoyl)amino]acetyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[2-[(2-iodobenzoyl)amino]acetyl]amino]propionic acid methyl ester Formula: C13H15IN2O5 MolecularWeight: 406.17307

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)CNC(=O)C1=CC=CC=C1I

Isomeric SMILES

COC(=O)[C@H](CO)NC(=O)CNC(=O)C1=CC=CC=C1I

InChI

InChI=1S/C13H15IN2O5/c1-21-13(20)10(7-17)16-11(18)6-15-12(19)8-4-2-3-5-9(8)14/h2-5,10,17H,6-7H2,1H3,(H,15,19)(H,16,18)/t10-/m0/s1