1-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanyl-octadecan-3-one

Systemtic Name: 1-(3-methoxy-4-oxidanyl-phenyl)-5-oxidanyl-octadecan-3-one Openeye Name: 5-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)octadecan-3-one CAS Name: 5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-3-octadecanone IUPAC Name: 5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)octadecan-3-one Traditional Name: 5-hydroxy-1-(4-hydroxy-3-methoxy-phenyl)octadecan-3-one Formula: C25H42O4 MolecularWeight: 406.59858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CC(=O)CCC1=CC(=C(C=C1)O)OC)O

Isomeric SMILES

CCCCCCCCCCCCCC(CC(=O)CCC1=CC(=C(C=C1)O)OC)O

InChI

InChI=1S/C25H42O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-22(26)20-23(27)17-15-21-16-18-24(28)25(19-21)29-2/h16,18-19,22,26,28H,3-15,17,20H2,1-2H3