5-[(E)-2-[(4,5-dimethoxy-2-nitro-phenyl)methylsulfonyl]ethenyl]-1,2,3-trimethoxy-benzene

Systemtic Name: 5-[(E)-2-[(4,5-dimethoxy-2-nitro-phenyl)methylsulfonyl]ethenyl]-1,2,3-trimethoxy-benzene Openeye Name: 5-[(E)-2-[(4,5-dimethoxy-2-nitro-phenyl)methylsulfonyl]vinyl]-1,2,3-trimethoxy-benzene CAS Name: 5-[(E)-2-[(4,5-dimethoxy-2-nitrophenyl)methylsulfonyl]ethenyl]-1,2,3-trimethoxybenzene IUPAC Name: 5-[(E)-2-[(4,5-dimethoxy-2-nitrophenyl)methylsulfonyl]ethenyl]-1,2,3-trimethoxybenzene Traditional Name: 5-[(E)-2-(4,5-dimethoxy-2-nitro-benzyl)sulfonylvinyl]-1,2,3-trimethoxy-benzene Formula: C20H23NO9S MolecularWeight: 453.46292

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C=CS(=O)(=O)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)/C=C/S(=O)(=O)CC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H23NO9S/c1-26-16-10-14(15(21(22)23)11-17(16)27-2)12-31(24,25)7-6-13-8-18(28-3)20(30-5)19(9-13)29-4/h6-11H,12H2,1-5H3/b7-6+