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

Systemtic Name: [4-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-methylsulfonyloxy-phenyl)-2,5-bis(dimethylamino)phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] ester IUPAC Name: [4-[2,5-bis(dimethylamino)-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-methylsulfonyloxy-phenyl)-2,5-bis(dimethylamino)phenyl]phenyl] ester Formula: C31H34N2O7S2 MolecularWeight: 610.74086

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)N(C)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

Isomeric SMILES

CN(C)C1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)N(C)C)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C31H34N2O7S2/c1-32(2)28-20-27(29(33(3)4)19-26(28)23-12-15-25(16-13-23)39-41(5,34)35)24-14-17-30(31(18-24)40-42(6,36)37)38-21-22-10-8-7-9-11-22/h7-20H,21H2,1-6H3