octadecanoyl 3,4,5-tris(oxidanyl)benzoate

Systemtic Name: octadecanoyl 3,4,5-tris(oxidanyl)benzoate Openeye Name: octadecanoyl 3,4,5-trihydroxybenzoate CAS Name: 3,4,5-trihydroxybenzoic acid 1-oxooctadecyl ester IUPAC Name: octadecanoyl 3,4,5-trihydroxybenzoate Traditional Name: 3,4,5-trihydroxybenzoic acid stearoyl ester Formula: C25H40O6 MolecularWeight: 436.5815

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C1=CC(=C(C(=C1)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(=O)C1=CC(=C(C(=C1)O)O)O

InChI

InChI=1S/C25H40O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23(28)31-25(30)20-18-21(26)24(29)22(27)19-20/h18-19,26-27,29H,2-17H2,1H3