4-[(3-butylcinnolin-4-yl)oxymethyl]benzenecarbonitrile

Systemtic Name: 4-[(3-butylcinnolin-4-yl)oxymethyl]benzenecarbonitrile Openeye Name: 4-[(3-butylcinnolin-4-yl)oxymethyl]benzonitrile CAS Name: 4-[(3-butyl-4-cinnolinyl)oxymethyl]benzonitrile IUPAC Name: 4-[(3-butylcinnolin-4-yl)oxymethyl]benzonitrile Traditional Name: 4-[(3-butylcinnolin-4-yl)oxymethyl]benzonitrile Formula: C20H19N3O MolecularWeight: 317.38436

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2N=N1)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2N=N1)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H19N3O/c1-2-3-7-19-20(17-6-4-5-8-18(17)22-23-19)24-14-16-11-9-15(13-21)10-12-16/h4-6,8-12H,2-3,7,14H2,1H3