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

Systemtic Name: 3-[4-(4-methoxyphenyl)pyrimidin-2-yl]benzoic acid Openeye Name: 3-[4-(4-methoxyphenyl)pyrimidin-2-yl]benzoic acid CAS Name: 3-[4-(4-methoxyphenyl)-2-pyrimidinyl]benzoic acid IUPAC Name: 3-[4-(4-methoxyphenyl)pyrimidin-2-yl]benzoic acid Traditional Name: 3-[4-(4-methoxyphenyl)pyrimidin-2-yl]benzoic acid Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=NC=C2)C3=CC(=CC=C3)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=NC=C2)C3=CC(=CC=C3)C(=O)O

InChI

InChI=1S/C18H14N2O3/c1-23-15-7-5-12(6-8-15)16-9-10-19-17(20-16)13-3-2-4-14(11-13)18(21)22/h2-11H,1H3,(H,21,22)