7-[4-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]phenoxy]heptanoic acid

Systemtic Name: 7-[4-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]phenoxy]heptanoic acid Openeye Name: 7-[4-[(4-benzyloxy-6-phenyl-pyrimidin-2-yl)amino]phenoxy]heptanoic acid CAS Name: 7-[4-[(4-phenyl-6-phenylmethoxy-2-pyrimidinyl)amino]phenoxy]heptanoic acid IUPAC Name: 7-[4-[(4-phenyl-6-phenylmethoxypyrimidin-2-yl)amino]phenoxy]heptanoic acid Traditional Name: 7-[4-[(4-benzoxy-6-phenyl-pyrimidin-2-yl)amino]phenoxy]enanthic acid Formula: C30H31N3O4 MolecularWeight: 497.58484

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=C(C=C4)OCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=C(C=C4)OCCCCCCC(=O)O

InChI

InChI=1S/C30H31N3O4/c34-29(35)15-9-1-2-10-20-36-26-18-16-25(17-19-26)31-30-32-27(24-13-7-4-8-14-24)21-28(33-30)37-22-23-11-5-3-6-12-23/h3-8,11-14,16-19,21H,1-2,9-10,15,20,22H2,(H,34,35)(H,31,32,33)