[5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]-2-phenylmethoxy-phenyl] methanesulfonate

Systemtic Name: [5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]-2-phenylmethoxy-phenyl] methanesulfonate Openeye Name: [2-benzyloxy-5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]-2-phenylmethoxyphenyl] ester IUPAC Name: [5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]-2-phenylmethoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-benzoxy-5-[3,6-dimethoxy-2-methylsulfonyloxy-4-(3-nitrophenyl)phenyl]phenyl] ester Formula: C29H27NO11S2 MolecularWeight: 629.65478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC(=CC=C2)[N+](=O)[O-])OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC(=CC=C2)[N+](=O)[O-])OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C29H27NO11S2/c1-37-26-17-23(20-11-8-12-22(15-20)30(31)32)28(38-2)29(41-43(4,35)36)27(26)21-13-14-24(25(16-21)40-42(3,33)34)39-18-19-9-6-5-7-10-19/h5-17H,18H2,1-4H3