[(1S,5S)-5-(3-methoxy-4-phenylmethoxy-phenyl)-5-phenyl-cyclopent-2-en-1-yl] methanesulfonate

Systemtic Name: [(1S,5S)-5-(3-methoxy-4-phenylmethoxy-phenyl)-5-phenyl-cyclopent-2-en-1-yl] methanesulfonate Openeye Name: [(1S,5S)-5-(4-benzyloxy-3-methoxy-phenyl)-5-phenyl-cyclopent-2-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [(1S,5S)-5-(3-methoxy-4-phenylmethoxyphenyl)-5-phenyl-1-cyclopent-2-enyl] ester IUPAC Name: [(1S,5S)-5-(3-methoxy-4-phenylmethoxyphenyl)-5-phenylcyclopent-2-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1S,5S)-5-(4-benzoxy-3-methoxy-phenyl)-5-phenyl-cyclopent-2-en-1-yl] ester Formula: C26H26O5S MolecularWeight: 450.54664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2(CC=CC2OS(=O)(=O)C)C3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)[C@]2(CC=C[C@@H]2OS(=O)(=O)C)C3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C26H26O5S/c1-29-24-18-22(15-16-23(24)30-19-20-10-5-3-6-11-20)26(21-12-7-4-8-13-21)17-9-14-25(26)31-32(2,27)28/h3-16,18,25H,17,19H2,1-2H3/t25-,26-/m0/s1