3-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]-4-methyl-benzoic acid

Systemtic Name: 3-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]-4-methyl-benzoic acid Openeye Name: 3-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]-4-methyl-benzoic acid CAS Name: 3-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]-4-methylbenzoic acid IUPAC Name: 3-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]-4-methylbenzoic acid Traditional Name: 3-[[5-(2-hydroxyethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]amino]-4-methyl-benzoic acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=O)C(=C(N2)C)CCO

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC2=NC(=O)C(=C(N2)C)CCO

InChI

InChI=1S/C15H17N3O4/c1-8-3-4-10(14(21)22)7-12(8)17-15-16-9(2)11(5-6-19)13(20)18-15/h3-4,7,19H,5-6H2,1-2H3,(H,21,22)(H2,16,17,18,20)