6-[5-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]naphthalen-1-yl]oxyhexanoic acid

Systemtic Name: 6-[5-[(4-phenyl-6-phenylmethoxy-pyrimidin-2-yl)amino]naphthalen-1-yl]oxyhexanoic acid Openeye Name: 6-[[5-[(4-benzyloxy-6-phenyl-pyrimidin-2-yl)amino]-1-naphthyl]oxy]hexanoic acid CAS Name: 6-[[5-[(4-phenyl-6-phenylmethoxy-2-pyrimidinyl)amino]-1-naphthalenyl]oxy]hexanoic acid IUPAC Name: 6-[5-[(4-phenyl-6-phenylmethoxypyrimidin-2-yl)amino]naphthalen-1-yl]oxyhexanoic acid Traditional Name: 6-[5-[(4-benzoxy-6-phenyl-pyrimidin-2-yl)amino]-1-naphthoxy]hexanoic acid Formula: C33H31N3O4 MolecularWeight: 533.61694

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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=CC5=C4C=CC=C5OCCCCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=NC(=NC(=C2)C3=CC=CC=C3)NC4=CC=CC5=C4C=CC=C5OCCCCCC(=O)O

InChI

InChI=1S/C33H31N3O4/c37-32(38)20-8-3-9-21-39-30-19-11-16-26-27(30)17-10-18-28(26)34-33-35-29(25-14-6-2-7-15-25)22-31(36-33)40-23-24-12-4-1-5-13-24/h1-2,4-7,10-19,22H,3,8-9,20-21,23H2,(H,37,38)(H,34,35,36)