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

Systemtic Name: 2-oxidanyl-5-[[4-oxidanyl-6-oxidanylidene-5-(phenylmethyl)-1H-pyrimidin-2-yl]amino]benzoic acid Openeye Name: 5-[(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)amino]-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-5-[[4-hydroxy-6-oxo-5-(phenylmethyl)-1H-pyrimidin-2-yl]amino]benzoic acid IUPAC Name: 5-[(5-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)amino]-2-hydroxybenzoic acid Traditional Name: 5-[(5-benzyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)amino]-2-hydroxy-benzoic acid Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC(=C(C=C3)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C(NC2=O)NC3=CC(=C(C=C3)O)C(=O)O)O

InChI

InChI=1S/C18H15N3O5/c22-14-7-6-11(9-12(14)17(25)26)19-18-20-15(23)13(16(24)21-18)8-10-4-2-1-3-5-10/h1-7,9,22H,8H2,(H,25,26)(H3,19,20,21,23,24)