2-[5-(2-cyano-4-fluoranyl-phenoxy)-2-nitro-phenoxy]-N-(1,3-dioxan-2-ylmethyl)propanamide

Systemtic Name: 2-[5-(2-cyano-4-fluoranyl-phenoxy)-2-nitro-phenoxy]-N-(1,3-dioxan-2-ylmethyl)propanamide Openeye Name: 2-[5-(2-cyano-4-fluoro-phenoxy)-2-nitro-phenoxy]-N-(1,3-dioxan-2-ylmethyl)propanamide CAS Name: 2-[5-(2-cyano-4-fluorophenoxy)-2-nitrophenoxy]-N-(1,3-dioxan-2-ylmethyl)propanamide IUPAC Name: 2-[5-(2-cyano-4-fluorophenoxy)-2-nitrophenoxy]-N-(1,3-dioxan-2-ylmethyl)propanamide Traditional Name: 2-[5-(2-cyano-4-fluoro-phenoxy)-2-nitro-phenoxy]-N-(1,3-dioxan-2-ylmethyl)propionamide Formula: C21H20FN3O7 MolecularWeight: 445.397803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1OCCCO1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)F)C#N)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NCC1OCCCO1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)F)C#N)[N+](=O)[O-]

InChI

InChI=1S/C21H20FN3O7/c1-13(21(26)24-12-20-29-7-2-8-30-20)31-19-10-16(4-5-17(19)25(27)28)32-18-6-3-15(22)9-14(18)11-23/h3-6,9-10,13,20H,2,7-8,12H2,1H3,(H,24,26)