(2R)-3-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]-2-methyl-propanenitrile

Systemtic Name: (2R)-3-[4-(3,4-dimethylphenyl)carbonylpiperazin-1-yl]-2-methyl-propanenitrile Openeye Name: (2R)-3-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-2-methyl-propanenitrile CAS Name: (2R)-3-[4-[(3,4-dimethylphenyl)-oxomethyl]-1-piperazinyl]-2-methylpropanenitrile IUPAC Name: (2R)-3-[4-(3,4-dimethylbenzoyl)piperazin-1-yl]-2-methylpropanenitrile Traditional Name: (2R)-3-[4-(3,4-dimethylbenzoyl)piperazino]-2-methyl-propionitrile Formula: C17H23N3O MolecularWeight: 285.38402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C[C@@H](C)C#N)C

InChI

InChI=1S/C17H23N3O/c1-13(11-18)12-19-6-8-20(9-7-19)17(21)16-5-4-14(2)15(3)10-16/h4-5,10,13H,6-9,12H2,1-3H3/t13-/m0/s1