[4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxy-phenyl)phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxy-phenyl)phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxy-phenyl)phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxyphenyl)phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxyphenyl)phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-pent-2-ynoxy-phenyl)phenyl]phenyl] ester Formula: C28H30O12S3 MolecularWeight: 654.7256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC#CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C

Isomeric SMILES

CCC#CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C

InChI

InChI=1S/C28H30O12S3/c1-7-8-9-16-37-23-15-12-20(17-24(23)39-42(5,31)32)26-25(35-2)18-22(27(36-3)28(26)40-43(6,33)34)19-10-13-21(14-11-19)38-41(4,29)30/h10-15,17-18H,7,16H2,1-6H3