2-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 2-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 2-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 2-[2-[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-2-oxoethoxy]benzonitrile IUPAC Name: 2-[2-[4-(2-methylpropanoyl)piperazin-1-yl]-2-oxoethoxy]benzonitrile Traditional Name: 2-[2-(4-isobutyrylpiperazino)-2-keto-ethoxy]benzonitrile Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCN(CC1)C(=O)COC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)C(=O)N1CCN(CC1)C(=O)COC2=CC=CC=C2C#N

InChI

InChI=1S/C17H21N3O3/c1-13(2)17(22)20-9-7-19(8-10-20)16(21)12-23-15-6-4-3-5-14(15)11-18/h3-6,13H,7-10,12H2,1-2H3