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3-[4-(4-methylphenyl)pyrimidin-2-yl]benzoic acid

3-[4-(4-methylphenyl)pyrimidin-2-yl]benzoic acid

Systemtic Name:3-[4-(4-methylphenyl)pyrimidin-2-yl]benzoic acid
Openeye Name:3-[4-(p-tolyl)pyrimidin-2-yl]benzoic acid
CAS Name:3-[4-(4-methylphenyl)-2-pyrimidinyl]benzoic acid
IUPAC Name:3-[4-(4-methylphenyl)pyrimidin-2-yl]benzoic acid
Traditional Name:3-[4-(p-tolyl)pyrimidin-2-yl]benzoic acid
Formula: C18H14N2O2
MolecularWeight: 290.31596
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NC=C2)C3=CC(=CC=C3)C(=O)O


Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NC=C2)C3=CC(=CC=C3)C(=O)O


InChI

InChI=1S/C18H14N2O2/c1-12-5-7-13(8-6-12)16-9-10-19-17(20-16)14-3-2-4-15(11-14)18(21)22/h2-11H,1H3,(H,21,22)


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