2-[2-tert-butyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-tert-butyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-tert-butyl-6-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]acetonitrile CAS Name: 2-[2-tert-butyl-6-[[3-(2-quinolinylmethoxy)phenoxy]methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-tert-butyl-6-[[3-(quinolin-2-ylmethoxy)phenoxy]methyl]phenoxy]acetonitrile Traditional Name: 2-[2-tert-butyl-6-[[3-(2-quinolylmethoxy)phenoxy]methyl]phenoxy]acetonitrile Formula: C29H28N2O3 MolecularWeight: 452.54422

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC(=C1OCC#N)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

Isomeric SMILES

CC(C)(C)C1=CC=CC(=C1OCC#N)COC2=CC(=CC=C2)OCC3=NC4=CC=CC=C4C=C3

InChI

InChI=1S/C29H28N2O3/c1-29(2,3)26-12-6-9-22(28(26)32-17-16-30)19-33-24-10-7-11-25(18-24)34-20-23-15-14-21-8-4-5-13-27(21)31-23/h4-15,18H,17,19-20H2,1-3H3