1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone

Systemtic Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-methoxy-2-nitro-phenoxy)ethanone Openeye Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidyl]-2-(4-methoxy-2-nitro-phenoxy)ethanone CAS Name: 1-[(2R,6R)-2,6-dimethyl-1-piperidinyl]-2-(4-methoxy-2-nitrophenoxy)ethanone IUPAC Name: 1-[(2R,6R)-2,6-dimethylpiperidin-1-yl]-2-(4-methoxy-2-nitrophenoxy)ethanone Traditional Name: 1-[(2R,6R)-2,6-dimethylpiperidino]-2-(4-methoxy-2-nitro-phenoxy)ethanone Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-])C

Isomeric SMILES

C[C@@H]1CCC[C@H](N1C(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-])C

InChI

InChI=1S/C16H22N2O5/c1-11-5-4-6-12(2)17(11)16(19)10-23-15-8-7-13(22-3)9-14(15)18(20)21/h7-9,11-12H,4-6,10H2,1-3H3/t11-,12-/m1/s1