4-bromanyl-2-[(2,6-dimethylphenyl)-(2-methoxyethanoyl)amino]butanoic acid

Systemtic Name: 4-bromanyl-2-[(2,6-dimethylphenyl)-(2-methoxyethanoyl)amino]butanoic acid Openeye Name: 4-bromo-2-(N-(2-methoxyacetyl)-2,6-dimethyl-anilino)butanoic acid CAS Name: 4-bromo-2-(N-(2-methoxy-1-oxoethyl)-2,6-dimethylanilino)butanoic acid IUPAC Name: 4-bromo-2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)butanoic acid Traditional Name: 4-bromo-2-(N-(2-methoxyacetyl)-2,6-dimethyl-anilino)butyric acid Formula: C15H20BrNO4 MolecularWeight: 358.2276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C(CCBr)C(=O)O)C(=O)COC

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C(CCBr)C(=O)O)C(=O)COC

InChI

InChI=1S/C15H20BrNO4/c1-10-5-4-6-11(2)14(10)17(13(18)9-21-3)12(7-8-16)15(19)20/h4-6,12H,7-9H2,1-3H3,(H,19,20)