4-[4-(4-hexoxyphenyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 4-[4-(4-hexoxyphenyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 4-[4-(4-hexoxyphenyl)piperazin-1-yl]benzonitrile CAS Name: 4-[4-(4-hexoxyphenyl)-1-piperazinyl]benzonitrile IUPAC Name: 4-[4-(4-hexoxyphenyl)piperazin-1-yl]benzonitrile Traditional Name: 4-[4-(4-hexoxyphenyl)piperazino]benzonitrile Formula: C23H29N3O MolecularWeight: 363.49586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)N2CCN(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H29N3O/c1-2-3-4-5-18-27-23-12-10-22(11-13-23)26-16-14-25(15-17-26)21-8-6-20(19-24)7-9-21/h6-13H,2-5,14-18H2,1H3