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

Systemtic Name: 4-[[5-(2-hydroxyethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid CAS Name: 2-hydroxy-4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid IUPAC Name: 2-hydroxy-4-[[5-(2-hydroxyethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]amino]benzoic acid Traditional Name: 2-hydroxy-4-[[5-(2-hydroxyethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]amino]benzoic acid Formula: C14H15N3O5 MolecularWeight: 305.286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)NC2=CC(=C(C=C2)C(=O)O)O)CCO

Isomeric SMILES

CC1=C(C(=O)N=C(N1)NC2=CC(=C(C=C2)C(=O)O)O)CCO

InChI

InChI=1S/C14H15N3O5/c1-7-9(4-5-18)12(20)17-14(15-7)16-8-2-3-10(13(21)22)11(19)6-8/h2-3,6,18-19H,4-5H2,1H3,(H,21,22)(H2,15,16,17,20)