(2S)-2-[(3-iodanylphenyl)carbonylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[(3-iodanylphenyl)carbonylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[(3-iodobenzoyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(3-iodophenyl)-oxomethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[(3-iodobenzoyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(3-iodobenzoyl)amino]-4-methyl-valerate Formula: C13H15INO3- MolecularWeight: 360.16757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C1=CC(=CC=C1)I

Isomeric SMILES

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

InChI

InChI=1S/C13H16INO3/c1-8(2)6-11(13(17)18)15-12(16)9-4-3-5-10(14)7-9/h3-5,7-8,11H,6H2,1-2H3,(H,15,16)(H,17,18)/p-1/t11-/m0/s1