5-hexadecoxy-4-phenylmethoxy-hexan-3-ol

Systemtic Name: 5-hexadecoxy-4-phenylmethoxy-hexan-3-ol Openeye Name: 4-benzyloxy-5-hexadecoxy-hexan-3-ol CAS Name: 5-hexadecoxy-4-phenylmethoxy-3-hexanol IUPAC Name: 5-hexadecoxy-4-phenylmethoxyhexan-3-ol Traditional Name: 4-benzoxy-5-cetyloxy-hexan-3-ol Formula: C29H52O3 MolecularWeight: 448.72138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(C)C(C(CC)O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(C)C(C(CC)O)OCC1=CC=CC=C1

InChI

InChI=1S/C29H52O3/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21-24-31-26(3)29(28(30)5-2)32-25-27-22-19-18-20-23-27/h18-20,22-23,26,28-30H,4-17,21,24-25H2,1-3H3