[2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-8-yl]-3-phenyl-propyl]phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-8-yl]-3-phenyl-propyl]phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-chroman-8-yl]-3-phenyl-propyl]phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-1-benzopyran-8-yl]-3-phenylpropyl]phenyl] ester IUPAC Name: [2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-3,4-dihydro-2H-chromen-8-yl]-3-phenylpropyl]phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-[(1R)-1-[(2S)-2-(3,4-dimethoxyphenyl)-5,7-dimethoxy-chroman-8-yl]-3-phenyl-propyl]phenyl] ester Formula: C35H35F3O8S MolecularWeight: 672.70781

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCC3=C(O2)C(=C(C=C3OC)OC)C(CCC4=CC=CC=C4)C5=CC=CC=C5OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H]2CCC3=C(O2)C(=C(C=C3OC)OC)[C@H](CCC4=CC=CC=C4)C5=CC=CC=C5OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C35H35F3O8S/c1-41-29-18-15-23(20-31(29)43-3)27-19-17-26-30(42-2)21-32(44-4)33(34(26)45-27)25(16-14-22-10-6-5-7-11-22)24-12-8-9-13-28(24)46-47(39,40)35(36,37)38/h5-13,15,18,20-21,25,27H,14,16-17,19H2,1-4H3/t25-,27+/m1/s1