2-[(4-chloranyl-2,6-dimethyl-phenyl)amino]-3-methyl-butanoic acid

Systemtic Name: 2-[(4-chloranyl-2,6-dimethyl-phenyl)amino]-3-methyl-butanoic acid Openeye Name: 2-(4-chloro-2,6-dimethyl-anilino)-3-methyl-butanoic acid CAS Name: 2-(4-chloro-2,6-dimethylanilino)-3-methylbutanoic acid IUPAC Name: 2-(4-chloro-2,6-dimethylanilino)-3-methylbutanoic acid Traditional Name: 2-(4-chloro-2,6-dimethyl-anilino)-3-methyl-butyric acid Formula: C13H18ClNO2 MolecularWeight: 255.74052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(C(C)C)C(=O)O)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1NC(C(C)C)C(=O)O)C)Cl

InChI

InChI=1S/C13H18ClNO2/c1-7(2)11(13(16)17)15-12-8(3)5-10(14)6-9(12)4/h5-7,11,15H,1-4H3,(H,16,17)