butyl (E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-2-cyano-prop-2-enoate

Systemtic Name: butyl (E)-3-[5-(2-bromanyl-4-nitro-phenyl)furan-2-yl]-2-cyano-prop-2-enoate Openeye Name: butyl (E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-2-cyano-prop-2-enoate CAS Name: (E)-3-[5-(2-bromo-4-nitrophenyl)-2-furanyl]-2-cyano-2-propenoic acid butyl ester IUPAC Name: butyl (E)-3-[5-(2-bromo-4-nitrophenyl)furan-2-yl]-2-cyanoprop-2-enoate Traditional Name: (E)-3-[5-(2-bromo-4-nitro-phenyl)-2-furyl]-2-cyano-acrylic acid butyl ester Formula: C18H15BrN2O5 MolecularWeight: 419.2261

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(=CC1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br)C#N

Isomeric SMILES

CCCCOC(=O)/C(=C/C1=CC=C(O1)C2=C(C=C(C=C2)[N+](=O)[O-])Br)/C#N

InChI

InChI=1S/C18H15BrN2O5/c1-2-3-8-25-18(22)12(11-20)9-14-5-7-17(26-14)15-6-4-13(21(23)24)10-16(15)19/h4-7,9-10H,2-3,8H2,1H3/b12-9+