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

Systemtic Name: 2-[4-(3-phenoxypropanoyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(3-phenoxypropanoyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(1-oxo-3-phenoxypropyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(3-phenoxypropanoyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(3-phenoxypropanoyl)piperazino]acetonitrile Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CC#N)C(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C15H19N3O2/c16-7-8-17-9-11-18(12-10-17)15(19)6-13-20-14-4-2-1-3-5-14/h1-5H,6,8-13H2