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

Systemtic Name: 4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(2-furylmethyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-(2-furanylmethyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(furan-2-ylmethyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(2-furfuryl)piperazino]methyl]benzonitrile Formula: C17H19N3O MolecularWeight: 281.35226

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC3=CC=CO3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)CC3=CC=CO3

InChI

InChI=1S/C17H19N3O/c18-12-15-3-5-16(6-4-15)13-19-7-9-20(10-8-19)14-17-2-1-11-21-17/h1-6,11H,7-10,13-14H2