3-[3-[6-(methylamino)pyrimidin-4-yl]phenyl]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[3-[6-(methylamino)pyrimidin-4-yl]phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-[6-(methylamino)pyrimidin-4-yl]phenyl]-3-oxo-propanoic acid CAS Name: 3-[3-[6-(methylamino)-4-pyrimidinyl]phenyl]-3-oxopropanoic acid IUPAC Name: 3-[3-[6-(methylamino)pyrimidin-4-yl]phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[3-[6-(methylamino)pyrimidin-4-yl]phenyl]propionic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)O

Isomeric SMILES

CNC1=NC=NC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)O

InChI

InChI=1S/C14H13N3O3/c1-15-13-6-11(16-8-17-13)9-3-2-4-10(5-9)12(18)7-14(19)20/h2-6,8H,7H2,1H3,(H,19,20)(H,15,16,17)