(2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol

Systemtic Name: (2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol Openeye Name: (2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol CAS Name: (2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol IUPAC Name: (2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol Traditional Name: (2S,3S)-4-[4-(4-hexylphenyl)phenoxy]butane-1,2,3-triol Formula: C22H30O4 MolecularWeight: 358.4712

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OCC(C(CO)O)O

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC[C@@H]([C@H](CO)O)O

InChI

InChI=1S/C22H30O4/c1-2-3-4-5-6-17-7-9-18(10-8-17)19-11-13-20(14-12-19)26-16-22(25)21(24)15-23/h7-14,21-25H,2-6,15-16H2,1H3/t21-,22-/m0/s1