(2S,3R)-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]-5-oxidanyl-pentanenitrile

Systemtic Name: (2S,3R)-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]-5-oxidanyl-pentanenitrile Openeye Name: (2S,3R)-5-hydroxy-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]pentanenitrile CAS Name: (2S,3R)-5-hydroxy-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]pentanenitrile IUPAC Name: (2S,3R)-5-hydroxy-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]pentanenitrile Traditional Name: (2S,3R)-5-hydroxy-2,3-bis[4-(2-methoxyethoxymethoxy)phenyl]valeronitrile Formula: C25H33NO7 MolecularWeight: 459.53202

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Descriptors Computed from Structure

Canonical SMILES:

COCCOCOC1=CC=C(C=C1)C(CCO)C(C#N)C2=CC=C(C=C2)OCOCCOC

Isomeric SMILES

COCCOCOC1=CC=C(C=C1)[C@H](CCO)[C@H](C#N)C2=CC=C(C=C2)OCOCCOC

InChI

InChI=1S/C25H33NO7/c1-28-13-15-30-18-32-22-7-3-20(4-8-22)24(11-12-27)25(17-26)21-5-9-23(10-6-21)33-19-31-16-14-29-2/h3-10,24-25,27H,11-16,18-19H2,1-2H3/t24-,25+/m0/s1