(2S)-2-[(3-iodanylphenyl)carbonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[(3-iodanylphenyl)carbonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[(3-iodobenzoyl)amino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[(3-iodophenyl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[(3-iodobenzoyl)amino]-3-methylbutanoic acid Traditional Name: (2S)-2-[(3-iodobenzoyl)amino]-3-methyl-butyric acid Formula: C12H14INO3 MolecularWeight: 347.14893

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)C1=CC(=CC=C1)I

InChI

InChI=1S/C12H14INO3/c1-7(2)10(12(16)17)14-11(15)8-4-3-5-9(13)6-8/h3-7,10H,1-2H3,(H,14,15)(H,16,17)/t10-/m0/s1