3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentanenitrile Openeye Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentanenitrile CAS Name: 3-[4-(2,3-dimethylphenyl)-1-piperazinyl]pentanenitrile IUPAC Name: 3-[4-(2,3-dimethylphenyl)piperazin-1-yl]pentanenitrile Traditional Name: 3-[4-(2,3-dimethylphenyl)piperazino]valeronitrile Formula: C17H25N3 MolecularWeight: 271.4005

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1CCN(CC1)C2=CC=CC(=C2C)C

Isomeric SMILES

CCC(CC#N)N1CCN(CC1)C2=CC=CC(=C2C)C

InChI

InChI=1S/C17H25N3/c1-4-16(8-9-18)19-10-12-20(13-11-19)17-7-5-6-14(2)15(17)3/h5-7,16H,4,8,10-13H2,1-3H3