2-(3-oxidanylidene-2-phenyl-piperazin-1-yl)ethanenitrile

Systemtic Name: 2-(3-oxidanylidene-2-phenyl-piperazin-1-yl)ethanenitrile Openeye Name: 2-(3-oxo-2-phenyl-piperazin-1-yl)acetonitrile CAS Name: 2-(3-oxo-2-phenyl-1-piperazinyl)acetonitrile IUPAC Name: 2-(3-oxo-2-phenylpiperazin-1-yl)acetonitrile Traditional Name: 2-(3-keto-2-phenyl-piperazino)acetonitrile Formula: C12H13N3O MolecularWeight: 215.25112

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C(=O)N1)C2=CC=CC=C2)CC#N

Isomeric SMILES

C1CN(C(C(=O)N1)C2=CC=CC=C2)CC#N

InChI

InChI=1S/C12H13N3O/c13-6-8-15-9-7-14-12(16)11(15)10-4-2-1-3-5-10/h1-5,11H,7-9H2,(H,14,16)