17-(2-bromanylethanoyl)-17,18,19-tris(oxidanyl)pentatriacontane-16,20-dione

Systemtic Name: 17-(2-bromanylethanoyl)-17,18,19-tris(oxidanyl)pentatriacontane-16,20-dione Openeye Name: 17-(2-bromoacetyl)-17,18,19-trihydroxy-pentatriacontane-16,20-dione CAS Name: 17-(2-bromo-1-oxoethyl)-17,18,19-trihydroxypentatriacontane-16,20-dione IUPAC Name: 17-(2-bromoacetyl)-17,18,19-trihydroxypentatriacontane-16,20-dione Traditional Name: 17-(2-bromoacetyl)-17,18,19-trihydroxy-pentatriacontane-16,20-dione Formula: C37H69BrO6 MolecularWeight: 689.84416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)CBr)O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C(C(C(C(=O)CCCCCCCCCCCCCCC)(C(=O)CBr)O)O)O

InChI

InChI=1S/C37H69BrO6/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-32(39)35(42)36(43)37(44,34(41)31-38)33(40)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,42-44H,3-31H2,1-2H3