[4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethyl-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethyl-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethyl-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] ester IUPAC Name: [4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethylphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-[3-ethyl-4-(3-methylbut-2-enoxy)phenyl]-2,5-dimethyl-phenyl]phenyl] ester Formula: C28H32O4S MolecularWeight: 464.61628

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)C2=C(C=C(C(=C2)C)C3=CC=C(C=C3)OS(=O)(=O)C)C)OCC=C(C)C

Isomeric SMILES

CCC1=C(C=CC(=C1)C2=C(C=C(C(=C2)C)C3=CC=C(C=C3)OS(=O)(=O)C)C)OCC=C(C)C

InChI

InChI=1S/C28H32O4S/c1-7-22-18-24(10-13-28(22)31-15-14-19(2)3)27-17-20(4)26(16-21(27)5)23-8-11-25(12-9-23)32-33(6,29)30/h8-14,16-18H,7,15H2,1-6H3