2-[2-ethyl-3-(quinolin-2-ylmethoxy)phenyl]butanenitrile

Systemtic Name: 2-[2-ethyl-3-(quinolin-2-ylmethoxy)phenyl]butanenitrile Openeye Name: 2-[2-ethyl-3-(2-quinolylmethoxy)phenyl]butanenitrile CAS Name: 2-[2-ethyl-3-(2-quinolinylmethoxy)phenyl]butanenitrile IUPAC Name: 2-[2-ethyl-3-(quinolin-2-ylmethoxy)phenyl]butanenitrile Traditional Name: 2-[2-ethyl-3-(2-quinolylmethoxy)phenyl]butyronitrile Formula: C22H22N2O MolecularWeight: 330.42288

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1OCC2=NC3=CC=CC=C3C=C2)C(CC)C#N

Isomeric SMILES

CCC1=C(C=CC=C1OCC2=NC3=CC=CC=C3C=C2)C(CC)C#N

InChI

InChI=1S/C22H22N2O/c1-3-16(14-23)20-9-7-11-22(19(20)4-2)25-15-18-13-12-17-8-5-6-10-21(17)24-18/h5-13,16H,3-4,15H2,1-2H3