2-[2-methyl-4-oxidanylidene-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[2-methyl-4-oxidanylidene-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[2-methyl-4-oxo-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[2-methyl-4-oxo-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[2-methyl-4-oxo-6-[(E)-2-pyridin-4-ylethenyl]-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[4-keto-2-methyl-6-[(E)-2-(4-pyridyl)vinyl]-1H-pyrimidin-5-yl]acetic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C(=C(N1)C=CC2=CC=NC=C2)CC(=O)O

Isomeric SMILES

CC1=NC(=O)C(=C(N1)/C=C/C2=CC=NC=C2)CC(=O)O

InChI

InChI=1S/C14H13N3O3/c1-9-16-12(3-2-10-4-6-15-7-5-10)11(8-13(18)19)14(20)17-9/h2-7H,8H2,1H3,(H,18,19)(H,16,17,20)/b3-2+