[5-(2-anthracen-9-ylcyclopropyl)-2,4-dimethoxy-phenyl] methanesulfonate

Systemtic Name: [5-(2-anthracen-9-ylcyclopropyl)-2,4-dimethoxy-phenyl] methanesulfonate Openeye Name: [5-[2-(9-anthryl)cyclopropyl]-2,4-dimethoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[2-(9-anthracenyl)cyclopropyl]-2,4-dimethoxyphenyl] ester IUPAC Name: [5-(2-anthracen-9-ylcyclopropyl)-2,4-dimethoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[2-(9-anthryl)cyclopropyl]-2,4-dimethoxy-phenyl] ester Formula: C26H24O5S MolecularWeight: 448.53076

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2CC2C3=C4C=CC=CC4=CC5=CC=CC=C53)OS(=O)(=O)C)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2CC2C3=C4C=CC=CC4=CC5=CC=CC=C53)OS(=O)(=O)C)OC

InChI

InChI=1S/C26H24O5S/c1-29-23-15-24(30-2)25(31-32(3,27)28)14-21(23)20-13-22(20)26-18-10-6-4-8-16(18)12-17-9-5-7-11-19(17)26/h4-12,14-15,20,22H,13H2,1-3H3