1-(2-oxidanyl-6-phenylmethoxy-phenyl)hexadecane-1,3-dione

Systemtic Name: 1-(2-oxidanyl-6-phenylmethoxy-phenyl)hexadecane-1,3-dione Openeye Name: 1-(2-benzyloxy-6-hydroxy-phenyl)hexadecane-1,3-dione CAS Name: 1-(2-hydroxy-6-phenylmethoxyphenyl)hexadecane-1,3-dione IUPAC Name: 1-(2-hydroxy-6-phenylmethoxyphenyl)hexadecane-1,3-dione Traditional Name: 1-(2-benzoxy-6-hydroxy-phenyl)hexadecane-1,3-dione Formula: C29H40O4 MolecularWeight: 452.6255

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)CC(=O)C1=C(C=CC=C1OCC2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCCCCCC(=O)CC(=O)C1=C(C=CC=C1OCC2=CC=CC=C2)O

InChI

InChI=1S/C29H40O4/c1-2-3-4-5-6-7-8-9-10-11-15-19-25(30)22-27(32)29-26(31)20-16-21-28(29)33-23-24-17-13-12-14-18-24/h12-14,16-18,20-21,31H,2-11,15,19,22-23H2,1H3