(3S,5S)-N-(4-chloranyl-3-nitro-phenyl)-3,5-dimethyl-piperidine-1-carboxamide

Systemtic Name: (3S,5S)-N-(4-chloranyl-3-nitro-phenyl)-3,5-dimethyl-piperidine-1-carboxamide Openeye Name: (3S,5S)-N-(4-chloro-3-nitro-phenyl)-3,5-dimethyl-piperidine-1-carboxamide CAS Name: (3S,5S)-N-(4-chloro-3-nitrophenyl)-3,5-dimethyl-1-piperidinecarboxamide IUPAC Name: (3S,5S)-N-(4-chloro-3-nitrophenyl)-3,5-dimethylpiperidine-1-carboxamide Traditional Name: (3S,5S)-N-(4-chloro-3-nitro-phenyl)-3,5-dimethyl-piperidine-1-carboxamide Formula: C14H18ClN3O3 MolecularWeight: 311.76402

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H18ClN3O3/c1-9-5-10(2)8-17(7-9)14(19)16-11-3-4-12(15)13(6-11)18(20)21/h3-4,6,9-10H,5,7-8H2,1-2H3,(H,16,19)/t9-,10-/m0/s1