(E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyano-N-(4-nitro-2-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyano-N-(4-nitro-2-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N-(2-hydroxy-4-nitro-phenyl)prop-2-enamide CAS Name: (E)-3-[5-(4-chlorophenyl)-2-furanyl]-2-cyano-N-(2-hydroxy-4-nitrophenyl)-2-propenamide IUPAC Name: (E)-3-[5-(4-chlorophenyl)furan-2-yl]-2-cyano-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide Traditional Name: (E)-3-[5-(4-chlorophenyl)-2-furyl]-2-cyano-N-(2-hydroxy-4-nitro-phenyl)acrylamide Formula: C20H12ClN3O5 MolecularWeight: 409.77938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=C(C#N)C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)/C=C(\C#N)/C(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O)Cl

InChI

InChI=1S/C20H12ClN3O5/c21-14-3-1-12(2-4-14)19-8-6-16(29-19)9-13(11-22)20(26)23-17-7-5-15(24(27)28)10-18(17)25/h1-10,25H,(H,23,26)/b13-9+