2-[4-(furan-3-ylmethyl)piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(furan-3-ylmethyl)piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(3-furylmethyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-(3-furanylmethyl)-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(furan-3-ylmethyl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(3-furfuryl)piperazino]benzonitrile Formula: C16H17N3O MolecularWeight: 267.32568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=COC=C2)C3=CC=CC=C3C#N

Isomeric SMILES

C1CN(CCN1CC2=COC=C2)C3=CC=CC=C3C#N

InChI

InChI=1S/C16H17N3O/c17-11-15-3-1-2-4-16(15)19-8-6-18(7-9-19)12-14-5-10-20-13-14/h1-5,10,13H,6-9,12H2