(2-bromanyl-4,5-dimethoxy-phenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate

Systemtic Name: (2-bromanyl-4,5-dimethoxy-phenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Openeye Name: (2-bromo-4,5-dimethoxy-phenyl)methyl (E)-3-(5-nitro-2-furyl)prop-2-enoate CAS Name: (E)-3-(5-nitro-2-furanyl)-2-propenoic acid (2-bromo-4,5-dimethoxyphenyl)methyl ester IUPAC Name: (2-bromo-4,5-dimethoxyphenyl)methyl (E)-3-(5-nitrofuran-2-yl)prop-2-enoate Traditional Name: (E)-3-(5-nitro-2-furyl)acrylic acid (2-bromo-4,5-dimethoxy-benzyl) ester Formula: C16H14BrNO7 MolecularWeight: 412.18886

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)COC(=O)C=CC2=CC=C(O2)[N+](=O)[O-])Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)COC(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-])Br)OC

InChI

InChI=1S/C16H14BrNO7/c1-22-13-7-10(12(17)8-14(13)23-2)9-24-16(19)6-4-11-3-5-15(25-11)18(20)21/h3-8H,9H2,1-2H3/b6-4+