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

Systemtic Name: 3-[(4-bromanyl-2,6-dimethyl-phenyl)amino]butanoic acid Openeye Name: 3-(4-bromo-2,6-dimethyl-anilino)butanoic acid CAS Name: 3-(4-bromo-2,6-dimethylanilino)butanoic acid IUPAC Name: 3-(4-bromo-2,6-dimethylanilino)butanoic acid Traditional Name: 3-(4-bromo-2,6-dimethyl-anilino)butyric acid Formula: C12H16BrNO2 MolecularWeight: 286.16494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16BrNO2/c1-7-4-10(13)5-8(2)12(7)14-9(3)6-11(15)16/h4-5,9,14H,6H2,1-3H3,(H,15,16)