4-[4-[2-(1,2,3,4-tetrazol-1-yl)ethanoyl]piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-[2-(1,2,3,4-tetrazol-1-yl)ethanoyl]piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-[2-(tetrazol-1-yl)acetyl]piperazine-1-carbonyl]benzonitrile CAS Name: 4-[oxo-[4-[1-oxo-2-(1-tetrazolyl)ethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[4-[2-(tetrazol-1-yl)acetyl]piperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-[2-(tetrazol-1-yl)acetyl]piperazine-1-carbonyl]benzonitrile Formula: C15H15N7O2 MolecularWeight: 325.3253

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C=NN=N2)C(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)CN2C=NN=N2)C(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C15H15N7O2/c16-9-12-1-3-13(4-2-12)15(24)21-7-5-20(6-8-21)14(23)10-22-11-17-18-19-22/h1-4,11H,5-8,10H2