2-[4-[(E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]prop-2-enoyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]prop-2-enoyl]phenoxy]ethanoate Openeye Name: 2-[4-[(E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]prop-2-enoyl]phenoxy]acetate CAS Name: 2-[4-[(E)-3-[5-(2-bromo-4-nitrophenyl)-2-furanyl]-1-oxoprop-2-enyl]phenoxy]acetate IUPAC Name: 2-[4-[(E)-3-[5-(2-bromo-4-nitrophenyl)furan-2-yl]prop-2-enoyl]phenoxy]acetate Traditional Name: 2-[4-[(E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]acryloyl]phenoxy]acetate Formula: C21H13BrNO7- MolecularWeight: 471.23442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)C=CC2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)OCC(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)/C=C/C2=CC=C(O2)C3=C(C=C(C=C3)[N+](=O)[O-])Br)OCC(=O)[O-]

InChI

InChI=1S/C21H14BrNO7/c22-18-11-14(23(27)28)3-8-17(18)20-10-7-16(30-20)6-9-19(24)13-1-4-15(5-2-13)29-12-21(25)26/h1-11H,12H2,(H,25,26)/p-1/b9-6+