1-[4-(2-dimethylaminoethyloxy)phenyl]-1,2-bis(4-phenylmethoxyphenyl)butane-1,4-diol

Systemtic Name: 1-[4-(2-dimethylaminoethyloxy)phenyl]-1,2-bis(4-phenylmethoxyphenyl)butane-1,4-diol Openeye Name: 1,2-bis(4-benzyloxyphenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]butane-1,4-diol CAS Name: 1-[4-(2-dimethylaminoethyloxy)phenyl]-1,2-bis(4-phenylmethoxyphenyl)butane-1,4-diol IUPAC Name: 1-[4-(2-dimethylaminoethyloxy)phenyl]-1,2-bis(4-phenylmethoxyphenyl)butane-1,4-diol Traditional Name: 1,2-bis(4-benzoxyphenyl)-1-[4-(2-dimethylaminoethyloxy)phenyl]butane-1,4-diol Formula: C40H43NO5 MolecularWeight: 617.77312

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)(C(CCO)C4=CC=C(C=C4)OCC5=CC=CC=C5)O

Isomeric SMILES

CN(C)CCOC1=CC=C(C=C1)C(C2=CC=C(C=C2)OCC3=CC=CC=C3)(C(CCO)C4=CC=C(C=C4)OCC5=CC=CC=C5)O

InChI

InChI=1S/C40H43NO5/c1-41(2)26-28-44-36-21-15-34(16-22-36)40(43,35-17-23-38(24-18-35)46-30-32-11-7-4-8-12-32)39(25-27-42)33-13-19-37(20-14-33)45-29-31-9-5-3-6-10-31/h3-24,39,42-43H,25-30H2,1-2H3