[2-fluoranyl-4-[4-(3-methanoyl-4-phenylmethoxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] methanesulfonate

Systemtic Name: [2-fluoranyl-4-[4-(3-methanoyl-4-phenylmethoxy-phenyl)-2,5-dimethoxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-formyl-phenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-fluoro-4-[4-(3-formyl-4-phenylmethoxyphenyl)-2,5-dimethoxyphenyl]phenyl] ester IUPAC Name: [2-fluoro-4-[4-(3-formyl-4-phenylmethoxyphenyl)-2,5-dimethoxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-formyl-phenyl)-2,5-dimethoxy-phenyl]-2-fluoro-phenyl] ester Formula: C29H25FO7S MolecularWeight: 536.568003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)C=O)OC)C4=CC(=C(C=C4)OS(=O)(=O)C)F

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)C=O)OC)C4=CC(=C(C=C4)OS(=O)(=O)C)F

InChI

InChI=1S/C29H25FO7S/c1-34-28-16-24(21-10-12-27(25(30)14-21)37-38(3,32)33)29(35-2)15-23(28)20-9-11-26(22(13-20)17-31)36-18-19-7-5-4-6-8-19/h4-17H,18H2,1-3H3