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

Systemtic Name: 2,3-bis(bromanyl)-4-[(3-chloranyl-4-methyl-phenyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 2,3-dibromo-4-(3-chloro-4-methyl-anilino)-4-oxo-butanoic acid CAS Name: 2,3-dibromo-4-(3-chloro-4-methylanilino)-4-oxobutanoic acid IUPAC Name: 2,3-dibromo-4-(3-chloro-4-methylanilino)-4-oxobutanoic acid Traditional Name: 2,3-dibromo-4-(3-chloro-4-methyl-anilino)-4-keto-butyric acid Formula: C11H10Br2ClNO3 MolecularWeight: 399.463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C(C(=O)O)Br)Br)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C(C(=O)O)Br)Br)Cl

InChI

InChI=1S/C11H10Br2ClNO3/c1-5-2-3-6(4-7(5)14)15-10(16)8(12)9(13)11(17)18/h2-4,8-9H,1H3,(H,15,16)(H,17,18)