(E)-N-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide

Systemtic Name: (E)-N-(3-chloranyl-4-fluoranyl-phenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Openeye Name: (E)-N-(3-chloro-4-fluoro-phenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide CAS Name: (E)-N-(3-chloro-4-fluorophenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)-2-propenamide IUPAC Name: (E)-N-(3-chloro-4-fluorophenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-enamide Traditional Name: (E)-N-(3-chloro-4-fluoro-phenyl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)acrylamide Formula: C17H12ClFN2O5 MolecularWeight: 378.738983

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)[N+](=O)[O-])C=CC(=O)NC3=CC(=C(C=C3)F)Cl)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)[N+](=O)[O-])/C=C/C(=O)NC3=CC(=C(C=C3)F)Cl)OCO1

InChI

InChI=1S/C17H12ClFN2O5/c18-14-7-12(2-3-15(14)19)20-16(22)4-1-10-5-13(21(23)24)6-11-8-25-9-26-17(10)11/h1-7H,8-9H2,(H,20,22)/b4-1+