2-(phenylmethyl)henicosane-1,2,3-triol

Systemtic Name: 2-(phenylmethyl)henicosane-1,2,3-triol Openeye Name: 2-benzylhenicosane-1,2,3-triol CAS Name: 2-(phenylmethyl)heneicosane-1,2,3-triol IUPAC Name: 2-benzylhenicosane-1,2,3-triol Traditional Name: 2-benzylheneicosane-1,2,3-triol Formula: C28H50O3 MolecularWeight: 434.6948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(C(CC1=CC=CC=C1)(CO)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(C(CC1=CC=CC=C1)(CO)O)O

InChI

InChI=1S/C28H50O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23-27(30)28(31,25-29)24-26-21-18-17-19-22-26/h17-19,21-22,27,29-31H,2-16,20,23-25H2,1H3