4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoic acid

Systemtic Name: 4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoic acid Openeye Name: 4-[2-(4-benzyloxyphenyl)pyrimidin-5-yl]benzoic acid CAS Name: 4-[2-(4-phenylmethoxyphenyl)-5-pyrimidinyl]benzoic acid IUPAC Name: 4-[2-(4-phenylmethoxyphenyl)pyrimidin-5-yl]benzoic acid Traditional Name: 4-[2-(4-benzoxyphenyl)pyrimidin-5-yl]benzoic acid Formula: C24H18N2O3 MolecularWeight: 382.41132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NC=C(C=N3)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H18N2O3/c27-24(28)20-8-6-18(7-9-20)21-14-25-23(26-15-21)19-10-12-22(13-11-19)29-16-17-4-2-1-3-5-17/h1-15H,16H2,(H,27,28)