(E,2R)-2,4-dimethyl-22-[4-(oxan-2-yloxy)phenyl]docos-3-en-1-ol

Systemtic Name: (E,2R)-2,4-dimethyl-22-[4-(oxan-2-yloxy)phenyl]docos-3-en-1-ol Openeye Name: (E,2R)-2,4-dimethyl-22-(4-tetrahydropyran-2-yloxyphenyl)docos-3-en-1-ol CAS Name: (E,2R)-2,4-dimethyl-22-[4-(2-oxanyloxy)phenyl]-3-docosen-1-ol IUPAC Name: (E,2R)-2,4-dimethyl-22-[4-(oxan-2-yloxy)phenyl]docos-3-en-1-ol Traditional Name: (E,2R)-2,4-dimethyl-22-(4-tetrahydropyran-2-yloxyphenyl)docos-3-en-1-ol Formula: C35H60O3 MolecularWeight: 528.8491

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)C=C(C)CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)OC2CCCCO2

Isomeric SMILES

C[C@@H](CO)/C=C(\C)/CCCCCCCCCCCCCCCCCCC1=CC=C(C=C1)OC2CCCCO2

InChI

InChI=1S/C35H60O3/c1-31(29-32(2)30-36)21-17-15-13-11-9-7-5-3-4-6-8-10-12-14-16-18-22-33-24-26-34(27-25-33)38-35-23-19-20-28-37-35/h24-27,29,32,35-36H,3-23,28,30H2,1-2H3/b31-29+/t32-,35?/m1/s1