(2S,3S,6S)-6-ethyl-3-nitro-2-phenyl-piperidine hydrobromide

Systemtic Name: (2S,3S,6S)-6-ethyl-3-nitro-2-phenyl-piperidine hydrobromide Openeye Name: (2S,3S,6S)-6-ethyl-3-nitro-2-phenyl-piperidine hydrobromide CAS Name: (2S,3S,6S)-6-ethyl-3-nitro-2-phenylpiperidine hydrobromide IUPAC Name: (2S,3S,6S)-6-ethyl-3-nitro-2-phenylpiperidine hydrobromide Traditional Name: (2S,3S,6S)-6-ethyl-3-nitro-2-phenyl-piperidine hydrobromide Formula: C13H19BrN2O2 MolecularWeight: 315.20616

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(C(N1)C2=CC=CC=C2)[N+](=O)[O-].Br

Isomeric SMILES

CC[C@H]1CC[C@@H]([C@@H](N1)C2=CC=CC=C2)[N+](=O)[O-].Br

InChI

InChI=1S/C13H18N2O2.BrH/c1-2-11-8-9-12(15(16)17)13(14-11)10-6-4-3-5-7-10;/h3-7,11-14H,2,8-9H2,1H3;1H/t11-,12-,13-;/m0./s1