(5-ethanoyl-2-ethoxy-phenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (5-acetyl-2-ethoxy-phenyl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid (5-acetyl-2-ethoxy-benzyl) ester Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)COC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C18H17NO7/c1-3-24-16-7-4-13(12(2)20)10-14(16)11-25-18(21)9-6-15-5-8-17(26-15)19(22)23/h4-10H,3,11H2,1-2H3/b9-6+