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

Systemtic Name: 3-[4-(furan-2-ylmethyl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-(2-furylmethyl)piperazine-1-carbonyl]benzonitrile CAS Name: 3-[[4-(2-furanylmethyl)-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 3-[4-(furan-2-ylmethyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-(2-furfuryl)piperazine-1-carbonyl]benzonitrile Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=CO2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C17H17N3O2/c18-12-14-3-1-4-15(11-14)17(21)20-8-6-19(7-9-20)13-16-5-2-10-22-16/h1-5,10-11H,6-9,13H2