4-octoxyquinoline-3-carbonitrile

Systemtic Name: 4-octoxyquinoline-3-carbonitrile Openeye Name: 4-octoxyquinoline-3-carbonitrile CAS Name: 4-octoxy-3-quinolinecarbonitrile IUPAC Name: 4-octoxyquinoline-3-carbonitrile Traditional Name: 4-octoxyquinoline-3-carbonitrile Formula: C18H22N2O MolecularWeight: 282.38008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=NC2=CC=CC=C21)C#N

Isomeric SMILES

CCCCCCCCOC1=C(C=NC2=CC=CC=C21)C#N

InChI

InChI=1S/C18H22N2O/c1-2-3-4-5-6-9-12-21-18-15(13-19)14-20-17-11-8-7-10-16(17)18/h7-8,10-11,14H,2-6,9,12H2,1H3