3-[2-(4-hexylpiperazin-1-yl)ethoxy]benzenecarbonitrile

Systemtic Name: 3-[2-(4-hexylpiperazin-1-yl)ethoxy]benzenecarbonitrile Openeye Name: 3-[2-(4-hexylpiperazin-1-yl)ethoxy]benzonitrile CAS Name: 3-[2-(4-hexyl-1-piperazinyl)ethoxy]benzonitrile IUPAC Name: 3-[2-(4-hexylpiperazin-1-yl)ethoxy]benzonitrile Traditional Name: 3-[2-(4-hexylpiperazino)ethoxy]benzonitrile Formula: C19H29N3O MolecularWeight: 315.45306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCN(CC1)CCOC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCCCCN1CCN(CC1)CCOC2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H29N3O/c1-2-3-4-5-9-21-10-12-22(13-11-21)14-15-23-19-8-6-7-18(16-19)17-20/h6-8,16H,2-5,9-15H2,1H3