3-[4-(2,6-dimethylphenyl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-(2,6-dimethylphenyl)piperazin-1-yl]propanenitrile Openeye Name: 3-[4-(2,6-dimethylphenyl)piperazin-1-yl]propanenitrile CAS Name: 3-[4-(2,6-dimethylphenyl)-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-(2,6-dimethylphenyl)piperazin-1-yl]propanenitrile Traditional Name: 3-[4-(2,6-dimethylphenyl)piperazino]propionitrile Formula: C15H21N3 MolecularWeight: 243.34734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2CCN(CC2)CCC#N

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2CCN(CC2)CCC#N

InChI

InChI=1S/C15H21N3/c1-13-5-3-6-14(2)15(13)18-11-9-17(10-12-18)8-4-7-16/h3,5-6H,4,8-12H2,1-2H3