2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(3-methylbutanoyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(3-methylbutanoyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(3-methyl-1-oxobutyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(3-methylbutanoyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-isovalerylpiperazino)acetonitrile Formula: C11H19N3O MolecularWeight: 209.28806

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19N3O/c1-10(2)9-11(15)14-7-5-13(4-3-12)6-8-14/h10H,4-9H2,1-2H3