2-[5-[6-(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid

Systemtic Name: 2-[5-[6-(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Openeye Name: 2-[5-[[6-(4-benzyloxy-6-phenyl-pyrimidin-2-yl)-2-naphthyl]oxy]pentyl]propanedioic acid CAS Name: 2-[5-[[6-(4-phenyl-6-phenylmethoxy-2-pyrimidinyl)-2-naphthalenyl]oxy]pentyl]propanedioic acid IUPAC Name: 2-[5-[6-(4-phenyl-6-phenylmethoxypyrimidin-2-yl)naphthalen-2-yl]oxypentyl]propanedioic acid Traditional Name: 2-[5-[6-(4-benzoxy-6-phenyl-pyrimidin-2-yl)-2-naphthoxy]pentyl]malonic acid Formula: C35H32N2O6 MolecularWeight: 576.63838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)C=C(C=C5)OCCCCCC(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC5=C(C=C4)C=C(C=C5)OCCCCCC(C(=O)O)C(=O)O

InChI

InChI=1S/C35H32N2O6/c38-34(39)30(35(40)41)14-8-3-9-19-42-29-18-17-26-20-28(16-15-27(26)21-29)33-36-31(25-12-6-2-7-13-25)22-32(37-33)43-23-24-10-4-1-5-11-24/h1-2,4-7,10-13,15-18,20-22,30H,3,8-9,14,19,23H2,(H,38,39)(H,40,41)