4-[(3-iodanyl-2-methyl-propanoyl)amino]-2-methyl-benzoic acid

Systemtic Name: 4-[(3-iodanyl-2-methyl-propanoyl)amino]-2-methyl-benzoic acid Openeye Name: 4-[(3-iodo-2-methyl-propanoyl)amino]-2-methyl-benzoic acid CAS Name: 4-[(3-iodo-2-methyl-1-oxopropyl)amino]-2-methylbenzoic acid IUPAC Name: 4-[(3-iodo-2-methylpropanoyl)amino]-2-methylbenzoic acid Traditional Name: 4-[(3-iodo-2-methyl-propanoyl)amino]-2-methyl-benzoic acid Formula: C12H14INO3 MolecularWeight: 347.14893

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C(C)CI)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C(C)CI)C(=O)O

InChI

InChI=1S/C12H14INO3/c1-7-5-9(3-4-10(7)12(16)17)14-11(15)8(2)6-13/h3-5,8H,6H2,1-2H3,(H,14,15)(H,16,17)