5-[(5-bromanyl-2-oxidanylidene-pyridin-1-yl)methyl]-2-methyl-furan-3-carboxylic acid

Systemtic Name: 5-[(5-bromanyl-2-oxidanylidene-pyridin-1-yl)methyl]-2-methyl-furan-3-carboxylic acid Openeye Name: 5-[(5-bromo-2-oxo-1-pyridyl)methyl]-2-methyl-furan-3-carboxylic acid CAS Name: 5-[(5-bromo-2-oxo-1-pyridinyl)methyl]-2-methyl-3-furancarboxylic acid IUPAC Name: 5-[(5-bromo-2-oxopyridin-1-yl)methyl]-2-methylfuran-3-carboxylic acid Traditional Name: 5-[(5-bromo-2-keto-1-pyridyl)methyl]-2-methyl-3-furoic acid Formula: C12H10BrNO4 MolecularWeight: 312.1161

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN2C=C(C=CC2=O)Br)C(=O)O

Isomeric SMILES

CC1=C(C=C(O1)CN2C=C(C=CC2=O)Br)C(=O)O

InChI

InChI=1S/C12H10BrNO4/c1-7-10(12(16)17)4-9(18-7)6-14-5-8(13)2-3-11(14)15/h2-5H,6H2,1H3,(H,16,17)