(2S)-2-(4-bromophenyl)-2-piperazin-1-yl-propanenitrile

Systemtic Name: (2S)-2-(4-bromophenyl)-2-piperazin-1-yl-propanenitrile Openeye Name: (2S)-2-(4-bromophenyl)-2-piperazin-1-yl-propanenitrile CAS Name: (2S)-2-(4-bromophenyl)-2-(1-piperazinyl)propanenitrile IUPAC Name: (2S)-2-(4-bromophenyl)-2-piperazin-1-ylpropanenitrile Traditional Name: (2S)-2-(4-bromophenyl)-2-piperazino-propionitrile Formula: C13H16BrN3 MolecularWeight: 294.19024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC=C(C=C1)Br)N2CCNCC2

Isomeric SMILES

C[C@@](C#N)(C1=CC=C(C=C1)Br)N2CCNCC2

InChI

InChI=1S/C13H16BrN3/c1-13(10-15,17-8-6-16-7-9-17)11-2-4-12(14)5-3-11/h2-5,16H,6-9H2,1H3/t13-/m1/s1