4-[(3-bromanyl-2,4,6-trimethyl-phenyl)-methyl-amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-bromanyl-2,4,6-trimethyl-phenyl)-methyl-amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-bromo-N,2,4,6-tetramethyl-anilino)-4-oxo-butanoic acid CAS Name: 4-(3-bromo-N,2,4,6-tetramethylanilino)-4-oxobutanoic acid IUPAC Name: 4-(3-bromo-N,2,4,6-tetramethylanilino)-4-oxobutanoic acid Traditional Name: 4-(3-bromo-N,2,4,6-tetramethyl-anilino)-4-keto-butyric acid Formula: C14H18BrNO3 MolecularWeight: 328.20162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1N(C)C(=O)CCC(=O)O)C)Br)C

Isomeric SMILES

CC1=CC(=C(C(=C1N(C)C(=O)CCC(=O)O)C)Br)C

InChI

InChI=1S/C14H18BrNO3/c1-8-7-9(2)14(10(3)13(8)15)16(4)11(17)5-6-12(18)19/h7H,5-6H2,1-4H3,(H,18,19)