(2S)-3-(4-butanoylpiperazin-1-yl)-2-methyl-propanenitrile

Systemtic Name: (2S)-3-(4-butanoylpiperazin-1-yl)-2-methyl-propanenitrile Openeye Name: (2S)-3-(4-butanoylpiperazin-1-yl)-2-methyl-propanenitrile CAS Name: (2S)-2-methyl-3-[4-(1-oxobutyl)-1-piperazinyl]propanenitrile IUPAC Name: (2S)-3-(4-butanoylpiperazin-1-yl)-2-methylpropanenitrile Traditional Name: (2S)-3-(4-butyrylpiperazino)-2-methyl-propionitrile Formula: C12H21N3O MolecularWeight: 223.31464

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N1CCN(CC1)CC(C)C#N

Isomeric SMILES

CCCC(=O)N1CCN(CC1)C[C@H](C)C#N

InChI

InChI=1S/C12H21N3O/c1-3-4-12(16)15-7-5-14(6-8-15)10-11(2)9-13/h11H,3-8,10H2,1-2H3/t11-/m1/s1