5-[1-[[3,5-bis(bromanyl)pyridin-2-yl]amino]-2-oxidanyl-2-oxidanylidene-ethyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[1-[[3,5-bis(bromanyl)pyridin-2-yl]amino]-2-oxidanyl-2-oxidanylidene-ethyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[1-[(3,5-dibromo-2-pyridyl)amino]-2-hydroxy-2-oxo-ethyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[1-[(3,5-dibromo-2-pyridinyl)amino]-2-hydroxy-2-oxoethyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[1-[(3,5-dibromopyridin-2-yl)amino]-2-hydroxy-2-oxoethyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[1-[(3,5-dibromo-2-pyridyl)amino]-2-hydroxy-2-keto-ethyl]-2-methyl-3-furoic acid Formula: C13H10Br2N2O5 MolecularWeight: 434.0369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(C(=O)O)NC2=C(C=C(C=N2)Br)Br)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)C(C(=O)O)NC2=C(C=C(C=N2)Br)Br)C(=O)O

InChI

InChI=1S/C13H10Br2N2O5/c1-5-7(12(18)19)3-9(22-5)10(13(20)21)17-11-8(15)2-6(14)4-16-11/h2-4,10H,1H3,(H,16,17)(H,18,19)(H,20,21)