(2R,6R)-N-[1-(4-chloranyl-3-nitro-phenyl)ethenyl]-2,6-dimethyl-piperidin-1-ium-1-amine

Systemtic Name: (2R,6R)-N-[1-(4-chloranyl-3-nitro-phenyl)ethenyl]-2,6-dimethyl-piperidin-1-ium-1-amine Openeye Name: (2R,6R)-N-[1-(4-chloro-3-nitro-phenyl)vinyl]-2,6-dimethyl-piperidin-1-ium-1-amine CAS Name: (2R,6R)-N-[1-(4-chloro-3-nitrophenyl)ethenyl]-2,6-dimethyl-1-piperidin-1-iumamine IUPAC Name: (2R,6R)-N-[1-(4-chloro-3-nitrophenyl)ethenyl]-2,6-dimethylpiperidin-1-ium-1-amine Traditional Name: 1-(4-chloro-3-nitro-phenyl)vinyl-[(2R,6R)-2,6-dimethylpiperidin-1-ium-1-yl]amine Formula: C15H21ClN3O2+ MolecularWeight: 310.79914

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1NC(=C)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

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

InChI

InChI=1S/C15H20ClN3O2/c1-10-5-4-6-11(2)18(10)17-12(3)13-7-8-14(16)15(9-13)19(20)21/h7-11,17H,3-6H2,1-2H3/p+1/t10-,11-/m1/s1