(5-chloranyl-2-nitro-phenyl)-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-nitro-phenyl)-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone Openeye Name: (5-chloro-2-nitro-phenyl)-[(2S,6S)-2,6-dimethyl-1-piperidyl]methanone CAS Name: (5-chloro-2-nitrophenyl)-[(2S,6S)-2,6-dimethyl-1-piperidinyl]methanone IUPAC Name: (5-chloro-2-nitrophenyl)-[(2S,6S)-2,6-dimethylpiperidin-1-yl]methanone Traditional Name: (5-chloro-2-nitro-phenyl)-[(2S,6S)-2,6-dimethylpiperidino]methanone Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1C(=O)C2=C(C=CC(=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H17ClN2O3/c1-9-4-3-5-10(2)16(9)14(18)12-8-11(15)6-7-13(12)17(19)20/h6-10H,3-5H2,1-2H3/t9-,10-/m0/s1