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

Systemtic Name: 3-[3-(6-methylpyrimidin-4-yl)phenyl]-3-oxidanylidene-propanoic acid Openeye Name: 3-[3-(6-methylpyrimidin-4-yl)phenyl]-3-oxo-propanoic acid CAS Name: 3-[3-(6-methyl-4-pyrimidinyl)phenyl]-3-oxopropanoic acid IUPAC Name: 3-[3-(6-methylpyrimidin-4-yl)phenyl]-3-oxopropanoic acid Traditional Name: 3-keto-3-[3-(6-methylpyrimidin-4-yl)phenyl]propionic acid Formula: C14H12N2O3 MolecularWeight: 256.25668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=NC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)O

Isomeric SMILES

CC1=NC=NC(=C1)C2=CC(=CC=C2)C(=O)CC(=O)O

InChI

InChI=1S/C14H12N2O3/c1-9-5-12(16-8-15-9)10-3-2-4-11(6-10)13(17)7-14(18)19/h2-6,8H,7H2,1H3,(H,18,19)