(E)-2-cyano-3-[4-ethoxy-3,5-bis(iodanyl)phenyl]-N-(4-nitro-2-oxidanyl-phenyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[4-ethoxy-3,5-bis(iodanyl)phenyl]-N-(4-nitro-2-oxidanyl-phenyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(4-ethoxy-3,5-diiodo-phenyl)-N-(2-hydroxy-4-nitro-phenyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(4-ethoxy-3,5-diiodophenyl)-N-(2-hydroxy-4-nitrophenyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-ethoxy-3,5-diiodophenyl)-N-(2-hydroxy-4-nitrophenyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-ethoxy-3,5-diiodo-phenyl)-N-(2-hydroxy-4-nitro-phenyl)acrylamide Formula: C18H13I2N3O5 MolecularWeight: 605.12186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1I)C=C(C#N)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)I

Isomeric SMILES

CCOC1=C(C=C(C=C1I)/C=C(\C#N)/C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O)I

InChI

InChI=1S/C18H13I2N3O5/c1-2-28-17-13(19)6-10(7-14(17)20)5-11(9-21)18(25)22-15-4-3-12(23(26)27)8-16(15)24/h3-8,24H,2H2,1H3,(H,22,25)/b11-5+