2-(5-fluoranyl-2-nitro-phenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide

Systemtic Name: 2-(5-fluoranyl-2-nitro-phenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]ethanamide Openeye Name: 2-(5-fluoro-2-nitro-phenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide CAS Name: 2-(5-fluoro-2-nitrophenoxy)-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]acetamide IUPAC Name: 2-(5-fluoro-2-nitrophenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Traditional Name: 2-(5-fluoro-2-nitro-phenoxy)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]acetamide Formula: C19H27FN3O5+ MolecularWeight: 396.433183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-])[NH+]3CCOCC3

Isomeric SMILES

C1CCC(CC1)(CNC(=O)COC2=C(C=CC(=C2)F)[N+](=O)[O-])[NH+]3CCOCC3

InChI

InChI=1S/C19H26FN3O5/c20-15-4-5-16(23(25)26)17(12-15)28-13-18(24)21-14-19(6-2-1-3-7-19)22-8-10-27-11-9-22/h4-5,12H,1-3,6-11,13-14H2,(H,21,24)/p+1