(2R,5S)-2-(4-butylphenyl)-5-(4-pentylphenyl)-1,4-dioxane

Systemtic Name: (2R,5S)-2-(4-butylphenyl)-5-(4-pentylphenyl)-1,4-dioxane Openeye Name: (2R,5S)-2-(4-butylphenyl)-5-(4-pentylphenyl)-1,4-dioxane CAS Name: (2R,5S)-2-(4-butylphenyl)-5-(4-pentylphenyl)-1,4-dioxane IUPAC Name: (2R,5S)-2-(4-butylphenyl)-5-(4-pentylphenyl)-1,4-dioxane Traditional Name: (2S,5R)-2-(4-amylphenyl)-5-(4-butylphenyl)-1,4-dioxane Formula: C25H34O2 MolecularWeight: 366.53626

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2COC(CO2)C3=CC=C(C=C3)CCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)[C@H]2CO[C@@H](CO2)C3=CC=C(C=C3)CCCC

InChI

InChI=1S/C25H34O2/c1-3-5-7-9-21-12-16-23(17-13-21)25-19-26-24(18-27-25)22-14-10-20(11-15-22)8-6-4-2/h10-17,24-25H,3-9,18-19H2,1-2H3/t24-,25+/m0/s1