3-[4-(phenylmethyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 3-[4-(phenylmethyl)piperazin-1-yl]pentanenitrile Openeye Name: 3-(4-benzylpiperazin-1-yl)pentanenitrile CAS Name: 3-[4-(phenylmethyl)-1-piperazinyl]pentanenitrile IUPAC Name: 3-(4-benzylpiperazin-1-yl)pentanenitrile Traditional Name: 3-(4-benzylpiperazino)valeronitrile Formula: C16H23N3 MolecularWeight: 257.37392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1CCN(CC1)CC2=CC=CC=C2

Isomeric SMILES

CCC(CC#N)N1CCN(CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H23N3/c1-2-16(8-9-17)19-12-10-18(11-13-19)14-15-6-4-3-5-7-15/h3-7,16H,2,8,10-14H2,1H3