5-[1-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanyl-2-oxidanylidene-ethyl]-2,4-dimethyl-furan-3-carboxylic acid

Systemtic Name: 5-[1-[(4-bromanyl-2-chloranyl-phenyl)amino]-2-oxidanyl-2-oxidanylidene-ethyl]-2,4-dimethyl-furan-3-carboxylic acid Openeye Name: 5-[1-(4-bromo-2-chloro-anilino)-2-hydroxy-2-oxo-ethyl]-2,4-dimethyl-furan-3-carboxylic acid CAS Name: 5-[1-(4-bromo-2-chloroanilino)-2-hydroxy-2-oxoethyl]-2,4-dimethyl-3-furancarboxylic acid IUPAC Name: 5-[1-(4-bromo-2-chloroanilino)-2-hydroxy-2-oxoethyl]-2,4-dimethylfuran-3-carboxylic acid Traditional Name: 5-[1-(4-bromo-2-chloro-anilino)-2-hydroxy-2-keto-ethyl]-2,4-dimethyl-3-furoic acid Formula: C15H13BrClNO5 MolecularWeight: 402.62442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C(=O)O)C)C(C(=O)O)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

CC1=C(OC(=C1C(=O)O)C)C(C(=O)O)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C15H13BrClNO5/c1-6-11(14(19)20)7(2)23-13(6)12(15(21)22)18-10-4-3-8(16)5-9(10)17/h3-5,12,18H,1-2H3,(H,19,20)(H,21,22)