3,3-dimethyl-7-phenoxy-2-[3-(quinolin-2-ylmethoxy)phenyl]heptan-2-ol

Systemtic Name: 3,3-dimethyl-7-phenoxy-2-[3-(quinolin-2-ylmethoxy)phenyl]heptan-2-ol Openeye Name: 3,3-dimethyl-7-phenoxy-2-[3-(2-quinolylmethoxy)phenyl]heptan-2-ol CAS Name: 3,3-dimethyl-7-phenoxy-2-[3-(2-quinolinylmethoxy)phenyl]-2-heptanol IUPAC Name: 3,3-dimethyl-7-phenoxy-2-[3-(quinolin-2-ylmethoxy)phenyl]heptan-2-ol Traditional Name: 3,3-dimethyl-7-phenoxy-2-[3-(2-quinolylmethoxy)phenyl]heptan-2-ol Formula: C31H35NO3 MolecularWeight: 469.6145

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCOC1=CC=CC=C1)C(C)(C2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)O

Isomeric SMILES

CC(C)(CCCCOC1=CC=CC=C1)C(C)(C2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C31H35NO3/c1-30(2,20-9-10-21-34-27-14-5-4-6-15-27)31(3,33)25-13-11-16-28(22-25)35-23-26-19-18-24-12-7-8-17-29(24)32-26/h4-8,11-19,22,33H,9-10,20-21,23H2,1-3H3