2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(3-methoxyphenyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(3-methoxyphenyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(3-methoxyphenyl)piperazino]acetonitrile Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)CC#N

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)CC#N

InChI

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