3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanenitrile Openeye Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanenitrile CAS Name: 3-[4-(1-oxo-3-phenoxypropyl)-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-(3-phenoxypropanoyl)piperazin-1-yl]propanenitrile Traditional Name: 3-[4-(3-phenoxypropanoyl)piperazino]propionitrile Formula: C16H21N3O2 MolecularWeight: 287.35684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C(=O)CCOC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCC#N)C(=O)CCOC2=CC=CC=C2

InChI

InChI=1S/C16H21N3O2/c17-8-4-9-18-10-12-19(13-11-18)16(20)7-14-21-15-5-2-1-3-6-15/h1-3,5-6H,4,7,9-14H2