2,2-bis[4-[(4-phenylpyrimidin-2-yl)methoxy]phenyl]pentanoic acid

Systemtic Name: 2,2-bis[4-[(4-phenylpyrimidin-2-yl)methoxy]phenyl]pentanoic acid Openeye Name: 2,2-bis[4-[(4-phenylpyrimidin-2-yl)methoxy]phenyl]pentanoic acid CAS Name: 2,2-bis[4-[(4-phenyl-2-pyrimidinyl)methoxy]phenyl]pentanoic acid IUPAC Name: 2,2-bis[4-[(4-phenylpyrimidin-2-yl)methoxy]phenyl]pentanoic acid Traditional Name: 2,2-bis[4-[(4-phenylpyrimidin-2-yl)methoxy]phenyl]valeric acid Formula: C39H34N4O4 MolecularWeight: 622.71166

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=C(C=C1)OCC2=NC=CC(=N2)C3=CC=CC=C3)(C4=CC=C(C=C4)OCC5=NC=CC(=N5)C6=CC=CC=C6)C(=O)O

Isomeric SMILES

CCCC(C1=CC=C(C=C1)OCC2=NC=CC(=N2)C3=CC=CC=C3)(C4=CC=C(C=C4)OCC5=NC=CC(=N5)C6=CC=CC=C6)C(=O)O

InChI

InChI=1S/C39H34N4O4/c1-2-23-39(38(44)45,30-13-17-32(18-14-30)46-26-36-40-24-21-34(42-36)28-9-5-3-6-10-28)31-15-19-33(20-16-31)47-27-37-41-25-22-35(43-37)29-11-7-4-8-12-29/h3-22,24-25H,2,23,26-27H2,1H3,(H,44,45)