4-[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]butanenitrile

Systemtic Name: 4-[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]butanenitrile Openeye Name: 4-[3-methyl-5-(2-quinolylmethoxy)phenoxy]butanenitrile CAS Name: 4-[3-methyl-5-(2-quinolinylmethoxy)phenoxy]butanenitrile IUPAC Name: 4-[3-methyl-5-(quinolin-2-ylmethoxy)phenoxy]butanenitrile Traditional Name: 4-[3-methyl-5-(2-quinolylmethoxy)phenoxy]butyronitrile Formula: C21H20N2O2 MolecularWeight: 332.3957

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCCC#N)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=CC(=CC(=C1)OCCCC#N)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H20N2O2/c1-16-12-19(24-11-5-4-10-22)14-20(13-16)25-15-18-9-8-17-6-2-3-7-21(17)23-18/h2-3,6-9,12-14H,4-5,11,15H2,1H3