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

Systemtic Name: [4-[2,5-dimethyl-4-[3-methyl-4-(3-methylbut-2-enoxy)phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethyl-4-[3-methyl-4-(3-methylbut-2-enoxy)phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethyl-4-[3-methyl-4-(3-methylbut-2-enoxy)phenyl]phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethyl-4-[3-methyl-4-(3-methylbut-2-enoxy)phenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethyl-4-[3-methyl-4-(3-methylbut-2-enoxy)phenyl]phenyl]phenyl] ester Formula: C27H30O4S MolecularWeight: 450.5897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)C)C3=CC(=C(C=C3)OCC=C(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)C)C3=CC(=C(C=C3)OCC=C(C)C)C

InChI

InChI=1S/C27H30O4S/c1-18(2)13-14-30-27-12-9-23(15-21(27)5)26-17-19(3)25(16-20(26)4)22-7-10-24(11-8-22)31-32(6,28)29/h7-13,15-17H,14H2,1-6H3