3-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]-2-methyl-propanoic acid

Systemtic Name: 3-[[2,6-bis(bromanyl)-4-methyl-phenyl]amino]-2-methyl-propanoic acid Openeye Name: 3-(2,6-dibromo-4-methyl-anilino)-2-methyl-propanoic acid CAS Name: 3-(2,6-dibromo-4-methylanilino)-2-methylpropanoic acid IUPAC Name: 3-(2,6-dibromo-4-methylanilino)-2-methylpropanoic acid Traditional Name: 3-(2,6-dibromo-4-methyl-anilino)-2-methyl-propionic acid Formula: C11H13Br2NO2 MolecularWeight: 351.03442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)NCC(C)C(=O)O)Br

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)NCC(C)C(=O)O)Br

InChI

InChI=1S/C11H13Br2NO2/c1-6-3-8(12)10(9(13)4-6)14-5-7(2)11(15)16/h3-4,7,14H,5H2,1-2H3,(H,15,16)