[4-fluoranyl-2,5-dimethoxy-6-(3-methoxy-4-phenylmethoxy-phenyl)-3-(4-methylphenyl)phenyl] methanesulfonate

Systemtic Name: [4-fluoranyl-2,5-dimethoxy-6-(3-methoxy-4-phenylmethoxy-phenyl)-3-(4-methylphenyl)phenyl] methanesulfonate Openeye Name: [2-(4-benzyloxy-3-methoxy-phenyl)-4-fluoro-3,6-dimethoxy-5-(p-tolyl)phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-fluoro-2,5-dimethoxy-6-(3-methoxy-4-phenylmethoxyphenyl)-3-(4-methylphenyl)phenyl] ester IUPAC Name: [4-fluoro-2,5-dimethoxy-6-(3-methoxy-4-phenylmethoxyphenyl)-3-(4-methylphenyl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-(4-benzoxy-3-methoxy-phenyl)-4-fluoro-3,6-dimethoxy-5-(p-tolyl)phenyl] ester Formula: C30H29FO7S MolecularWeight: 552.610463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C(C(=C2F)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)OS(=O)(=O)C)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C(C(=C2F)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)OS(=O)(=O)C)OC

InChI

InChI=1S/C30H29FO7S/c1-19-11-13-21(14-12-19)25-27(31)28(35-3)26(30(29(25)36-4)38-39(5,32)33)22-15-16-23(24(17-22)34-2)37-18-20-9-7-6-8-10-20/h6-17H,18H2,1-5H3