[5-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]-2-phenylmethoxy-phenyl] methanesulfonate

Systemtic Name: [5-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]-2-phenylmethoxy-phenyl] methanesulfonate Openeye Name: [2-benzyloxy-5-[4-(4-benzyloxy-3-methylsulfonyloxy-phenyl)-2,5-bis(dimethylamino)phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-phenylmethoxyphenyl] ester IUPAC Name: [5-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-phenylmethoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-benzoxy-5-[4-(4-benzoxy-3-methylsulfonyloxy-phenyl)-2,5-bis(dimethylamino)phenyl]phenyl] ester Formula: C38H40N2O8S2 MolecularWeight: 716.8628

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OS(=O)(=O)C)N(C)C)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OS(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC(=C(C=C1C2=CC(=C(C=C2)OCC3=CC=CC=C3)OS(=O)(=O)C)N(C)C)C4=CC(=C(C=C4)OCC5=CC=CC=C5)OS(=O)(=O)C

InChI

InChI=1S/C38H40N2O8S2/c1-39(2)33-23-32(30-18-20-36(38(22-30)48-50(6,43)44)46-26-28-15-11-8-12-16-28)34(40(3)4)24-31(33)29-17-19-35(37(21-29)47-49(5,41)42)45-25-27-13-9-7-10-14-27/h7-24H,25-26H2,1-6H3