2-[4-(3-cyclobutyl-3-oxidanyl-2-oxidanylidene-3-phenyl-propyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(3-cyclobutyl-3-oxidanyl-2-oxidanylidene-3-phenyl-propyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(3-cyclobutyl-3-hydroxy-2-oxo-3-phenyl-propyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(3-cyclobutyl-3-hydroxy-2-oxo-3-phenylpropyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(3-cyclobutyl-3-hydroxy-2-oxo-3-phenylpropyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(3-cyclobutyl-3-hydroxy-2-keto-3-phenyl-propyl)piperazino]acetonitrile Formula: C19H25N3O2 MolecularWeight: 327.4207

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC#N)O

Isomeric SMILES

C1CC(C1)C(C2=CC=CC=C2)(C(=O)CN3CCN(CC3)CC#N)O

InChI

InChI=1S/C19H25N3O2/c20-9-10-21-11-13-22(14-12-21)15-18(23)19(24,17-7-4-8-17)16-5-2-1-3-6-16/h1-3,5-6,17,24H,4,7-8,10-15H2