(2S)-3-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]-2-methyl-propanenitrile

Systemtic Name: (2S)-3-[4-[2-(4-methoxyphenyl)ethanoyl]piperazin-1-yl]-2-methyl-propanenitrile Openeye Name: (2S)-3-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]-2-methyl-propanenitrile CAS Name: (2S)-3-[4-[2-(4-methoxyphenyl)-1-oxoethyl]-1-piperazinyl]-2-methylpropanenitrile IUPAC Name: (2S)-3-[4-[2-(4-methoxyphenyl)acetyl]piperazin-1-yl]-2-methylpropanenitrile Traditional Name: (2S)-3-[4-[2-(4-methoxyphenyl)acetyl]piperazino]-2-methyl-propionitrile Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C(=O)CC2=CC=C(C=C2)OC)C#N

Isomeric SMILES

C[C@@H](CN1CCN(CC1)C(=O)CC2=CC=C(C=C2)OC)C#N

InChI

InChI=1S/C17H23N3O2/c1-14(12-18)13-19-7-9-20(10-8-19)17(21)11-15-3-5-16(22-2)6-4-15/h3-6,14H,7-11,13H2,1-2H3/t14-/m1/s1