4-[(4-bromanyl-3-methyl-phenyl)carbamoyl]-5-methyl-1,2-oxazole-3-carboxylic acid

Systemtic Name: 4-[(4-bromanyl-3-methyl-phenyl)carbamoyl]-5-methyl-1,2-oxazole-3-carboxylic acid Openeye Name: 4-[(4-bromo-3-methyl-phenyl)carbamoyl]-5-methyl-isoxazole-3-carboxylic acid CAS Name: 4-[(4-bromo-3-methylanilino)-oxomethyl]-5-methyl-3-isoxazolecarboxylic acid IUPAC Name: 4-[(4-bromo-3-methylphenyl)carbamoyl]-5-methyl-1,2-oxazole-3-carboxylic acid Traditional Name: 4-[(4-bromo-3-methyl-phenyl)carbamoyl]-5-methyl-isoxazole-3-carboxylic acid Formula: C13H11BrN2O4 MolecularWeight: 339.14144

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(ON=C2C(=O)O)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(ON=C2C(=O)O)C)Br

InChI

InChI=1S/C13H11BrN2O4/c1-6-5-8(3-4-9(6)14)15-12(17)10-7(2)20-16-11(10)13(18)19/h3-5H,1-2H3,(H,15,17)(H,18,19)