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

Systemtic Name: 2-oxidanyl-5-[(4-oxidanyl-6-oxidanylidene-5-prop-2-enyl-1H-pyrimidin-2-yl)amino]benzoic acid Openeye Name: 5-[(5-allyl-4-hydroxy-6-oxo-1H-pyrimidin-2-yl)amino]-2-hydroxy-benzoic acid CAS Name: 2-hydroxy-5-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)amino]benzoic acid IUPAC Name: 2-hydroxy-5-[(4-hydroxy-6-oxo-5-prop-2-enyl-1H-pyrimidin-2-yl)amino]benzoic acid Traditional Name: 5-[(5-allyl-4-hydroxy-6-keto-1H-pyrimidin-2-yl)amino]-2-hydroxy-benzoic acid Formula: C14H13N3O5 MolecularWeight: 303.27012

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(N=C(NC1=O)NC2=CC(=C(C=C2)O)C(=O)O)O

Isomeric SMILES

C=CCC1=C(N=C(NC1=O)NC2=CC(=C(C=C2)O)C(=O)O)O

InChI

InChI=1S/C14H13N3O5/c1-2-3-8-11(19)16-14(17-12(8)20)15-7-4-5-10(18)9(6-7)13(21)22/h2,4-6,18H,1,3H2,(H,21,22)(H3,15,16,17,19,20)