[4-oxidanyl-3-(3-oxidanylidenedodecanoyl)phenyl] benzoate

Systemtic Name: [4-oxidanyl-3-(3-oxidanylidenedodecanoyl)phenyl] benzoate Openeye Name: [4-hydroxy-3-(3-oxododecanoyl)phenyl] benzoate CAS Name: benzoic acid [3-(1,3-dioxododecyl)-4-hydroxyphenyl] ester IUPAC Name: [4-hydroxy-3-(3-oxododecanoyl)phenyl] benzoate Traditional Name: benzoic acid [4-hydroxy-3-(3-ketododecanoyl)phenyl] ester Formula: C25H30O5 MolecularWeight: 410.5027

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)CC(=O)C1=C(C=CC(=C1)OC(=O)C2=CC=CC=C2)O

Isomeric SMILES

CCCCCCCCCC(=O)CC(=O)C1=C(C=CC(=C1)OC(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C25H30O5/c1-2-3-4-5-6-7-11-14-20(26)17-24(28)22-18-21(15-16-23(22)27)30-25(29)19-12-9-8-10-13-19/h8-10,12-13,15-16,18,27H,2-7,11,14,17H2,1H3