N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitro-phenoxy)ethanamide

Systemtic Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitro-phenoxy)ethanamide Openeye Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitro-phenoxy)acetamide CAS Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitrophenoxy)acetamide IUPAC Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitrophenoxy)acetamide Traditional Name: N-[(1S,2S,3S)-2,3-dimethylcyclohexyl]-2-(4-methoxy-2-nitro-phenoxy)acetamide Formula: C17H24N2O5 MolecularWeight: 336.38286

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)COC2=C(C=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O5/c1-11-5-4-6-14(12(11)2)18-17(20)10-24-16-8-7-13(23-3)9-15(16)19(21)22/h7-9,11-12,14H,4-6,10H2,1-3H3,(H,18,20)/t11-,12-,14-/m0/s1