5-methyl-2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]benzoic acid

Systemtic Name: 5-methyl-2-[2-(2-oxidanylidenepyrimidin-1-yl)ethanoylamino]benzoic acid Openeye Name: 5-methyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]benzoic acid CAS Name: 5-methyl-2-[[1-oxo-2-(2-oxo-1-pyrimidinyl)ethyl]amino]benzoic acid IUPAC Name: 5-methyl-2-[[2-(2-oxopyrimidin-1-yl)acetyl]amino]benzoic acid Traditional Name: 2-[[2-(2-ketopyrimidin-1-yl)acetyl]amino]-5-methyl-benzoic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CN2C=CC=NC2=O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CN2C=CC=NC2=O)C(=O)O

InChI

InChI=1S/C14H13N3O4/c1-9-3-4-11(10(7-9)13(19)20)16-12(18)8-17-6-2-5-15-14(17)21/h2-7H,8H2,1H3,(H,16,18)(H,19,20)