2-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(1-phenyl-1,2,3,4-tetrazol-5-yl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(1-phenyl-5-tetrazolyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(1-phenyltetrazol-5-yl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(1-phenyltetrazol-5-yl)piperazino]acetonitrile Formula: C13H15N7 MolecularWeight: 269.3051

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC#N)C2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C13H15N7/c14-6-7-18-8-10-19(11-9-18)13-15-16-17-20(13)12-4-2-1-3-5-12/h1-5H,7-11H2