(E)-2-cyano-3-(3-ethoxy-5-nitro-2-oxidanyl-phenyl)-N-(furan-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(3-ethoxy-5-nitro-2-oxidanyl-phenyl)-N-(furan-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-(3-ethoxy-2-hydroxy-5-nitro-phenyl)-N-(2-furylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-(3-ethoxy-2-hydroxy-5-nitrophenyl)-N-(2-furanylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-(3-ethoxy-2-hydroxy-5-nitrophenyl)-N-(furan-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-(3-ethoxy-2-hydroxy-5-nitro-phenyl)-N-(2-furfuryl)acrylamide Formula: C17H15N3O6 MolecularWeight: 357.3175

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])C=C(C#N)C(=O)NCC2=CC=CO2)O

Isomeric SMILES

CCOC1=C(C(=CC(=C1)[N+](=O)[O-])/C=C(\C#N)/C(=O)NCC2=CC=CO2)O

InChI

InChI=1S/C17H15N3O6/c1-2-25-15-8-13(20(23)24)7-11(16(15)21)6-12(9-18)17(22)19-10-14-4-3-5-26-14/h3-8,21H,2,10H2,1H3,(H,19,22)/b12-6+