2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-3,3-dimethyl-butanoic acid

Systemtic Name: 2-[(5-chloranyl-4-iodanyl-2-methoxy-phenyl)carbonylamino]-3,3-dimethyl-butanoic acid Openeye Name: 2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-3,3-dimethyl-butanoic acid CAS Name: 2-[[(5-chloro-4-iodo-2-methoxyphenyl)-oxomethyl]amino]-3,3-dimethylbutanoic acid IUPAC Name: 2-[(5-chloro-4-iodo-2-methoxybenzoyl)amino]-3,3-dimethylbutanoic acid Traditional Name: 2-[(5-chloro-4-iodo-2-methoxy-benzoyl)amino]-3,3-dimethyl-butyric acid Formula: C14H17ClINO4 MolecularWeight: 425.64655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1OC)I)Cl

Isomeric SMILES

CC(C)(C)C(C(=O)O)NC(=O)C1=CC(=C(C=C1OC)I)Cl

InChI

InChI=1S/C14H17ClINO4/c1-14(2,3)11(13(19)20)17-12(18)7-5-8(15)9(16)6-10(7)21-4/h5-6,11H,1-4H3,(H,17,18)(H,19,20)