2-[(E)-2-[2-azido-6-(2-methylpropylsulfonyl)-4-nitro-phenyl]ethenyl]furan

Systemtic Name: 2-[(E)-2-[2-azido-6-(2-methylpropylsulfonyl)-4-nitro-phenyl]ethenyl]furan Openeye Name: 2-[(E)-2-(2-azido-6-isobutylsulfonyl-4-nitro-phenyl)vinyl]furan CAS Name: 2-[(E)-2-[2-azido-6-(2-methylpropylsulfonyl)-4-nitrophenyl]ethenyl]furan IUPAC Name: 2-[(E)-2-[2-azido-6-(2-methylpropylsulfonyl)-4-nitrophenyl]ethenyl]furan Traditional Name: 2-[(E)-2-(2-azido-6-isobutylsulfonyl-4-nitro-phenyl)vinyl]furan Formula: C16H16N4O5S MolecularWeight: 376.38704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CS(=O)(=O)C1=C(C(=CC(=C1)[N+](=O)[O-])N=[N+]=[N-])C=CC2=CC=CO2

Isomeric SMILES

CC(C)CS(=O)(=O)C1=C(C(=CC(=C1)[N+](=O)[O-])N=[N+]=[N-])/C=C/C2=CC=CO2

InChI

InChI=1S/C16H16N4O5S/c1-11(2)10-26(23,24)16-9-12(20(21)22)8-15(18-19-17)14(16)6-5-13-4-3-7-25-13/h3-9,11H,10H2,1-2H3/b6-5+