2-methoxy-2-(4-phenylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-methoxy-2-(4-phenylpiperazin-1-yl)ethanenitrile Openeye Name: 2-methoxy-2-(4-phenylpiperazin-1-yl)acetonitrile CAS Name: 2-methoxy-2-(4-phenyl-1-piperazinyl)acetonitrile IUPAC Name: 2-methoxy-2-(4-phenylpiperazin-1-yl)acetonitrile Traditional Name: 2-methoxy-2-(4-phenylpiperazino)acetonitrile Formula: C13H17N3O MolecularWeight: 231.29358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(C#N)N1CCN(CC1)C2=CC=CC=C2

Isomeric SMILES

COC(C#N)N1CCN(CC1)C2=CC=CC=C2

InChI

InChI=1S/C13H17N3O/c1-17-13(11-14)16-9-7-15(8-10-16)12-5-3-2-4-6-12/h2-6,13H,7-10H2,1H3