2-[4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]phenyl]ethanoic acid

Systemtic Name: 2-[4-[2-oxidanylidene-2-(pyrimidin-2-ylamino)ethoxy]phenyl]ethanoic acid Openeye Name: 2-[4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]phenyl]acetic acid CAS Name: 2-[4-[2-oxo-2-(2-pyrimidinylamino)ethoxy]phenyl]acetic acid IUPAC Name: 2-[4-[2-oxo-2-(pyrimidin-2-ylamino)ethoxy]phenyl]acetic acid Traditional Name: 2-[4-[2-keto-2-(2-pyrimidylamino)ethoxy]phenyl]acetic acid Formula: C14H13N3O4 MolecularWeight: 287.27072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)NC(=O)COC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1=CN=C(N=C1)NC(=O)COC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C14H13N3O4/c18-12(17-14-15-6-1-7-16-14)9-21-11-4-2-10(3-5-11)8-13(19)20/h1-7H,8-9H2,(H,19,20)(H,15,16,17,18)