(2S)-1,4-bis[bis(4-methoxyphenyl)-phenyl-methoxy]butan-2-ol

Systemtic Name: (2S)-1,4-bis[bis(4-methoxyphenyl)-phenyl-methoxy]butan-2-ol Openeye Name: (2S)-1,4-bis[bis(4-methoxyphenyl)-phenyl-methoxy]butan-2-ol CAS Name: (2S)-1,4-bis[bis(4-methoxyphenyl)-phenylmethoxy]-2-butanol IUPAC Name: (2S)-1,4-bis[bis(4-methoxyphenyl)-phenylmethoxy]butan-2-ol Traditional Name: (2S)-1,4-bis[bis(4-methoxyphenyl)-phenyl-methoxy]butan-2-ol Formula: C46H46O7 MolecularWeight: 710.85324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCCC(COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)OC)OCC[C@@H](COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)O

InChI

InChI=1S/C46H46O7/c1-48-41-23-15-36(16-24-41)45(34-11-7-5-8-12-34,37-17-25-42(49-2)26-18-37)52-32-31-40(47)33-53-46(35-13-9-6-10-14-35,38-19-27-43(50-3)28-20-38)39-21-29-44(51-4)30-22-39/h5-30,40,47H,31-33H2,1-4H3/t40-/m0/s1