(4-chloranyl-2-nitro-phenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone

Systemtic Name: (4-chloranyl-2-nitro-phenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone Openeye Name: (4-chloro-2-nitro-phenyl)-[(3S,5S)-3,5-dimethyl-1-piperidyl]methanone CAS Name: (4-chloro-2-nitrophenyl)-[(3S,5S)-3,5-dimethyl-1-piperidinyl]methanone IUPAC Name: (4-chloro-2-nitrophenyl)-[(3S,5S)-3,5-dimethylpiperidin-1-yl]methanone Traditional Name: (4-chloro-2-nitro-phenyl)-[(3S,5S)-3,5-dimethylpiperidino]methanone Formula: C14H17ClN2O3 MolecularWeight: 296.74938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H17ClN2O3/c1-9-5-10(2)8-16(7-9)14(18)12-4-3-11(15)6-13(12)17(19)20/h3-4,6,9-10H,5,7-8H2,1-2H3/t9-,10-/m0/s1