2-[[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(3-iodoanilino)-2-oxo-ethyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(3-iodoanilino)-2-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(3-iodoanilino)-2-oxoethyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(3-iodoanilino)-2-keto-ethyl]amino]-3-methyl-butyric acid Formula: C13H17IN2O3 MolecularWeight: 376.19015

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NCC(=O)NC1=CC(=CC=C1)I

Isomeric SMILES

CC(C)C(C(=O)O)NCC(=O)NC1=CC(=CC=C1)I

InChI

InChI=1S/C13H17IN2O3/c1-8(2)12(13(18)19)15-7-11(17)16-10-5-3-4-9(14)6-10/h3-6,8,12,15H,7H2,1-2H3,(H,16,17)(H,18,19)