1-[(5Z)-4-bromanyl-5-(bromanylmethylidene)-2-oxidanylidene-furan-3-yl]butyl octadecanoate

Systemtic Name: 1-[(5Z)-4-bromanyl-5-(bromanylmethylidene)-2-oxidanylidene-furan-3-yl]butyl octadecanoate Openeye Name: 1-[(5Z)-4-bromo-5-(bromomethylene)-2-oxo-3-furyl]butyl octadecanoate CAS Name: octadecanoic acid 1-[(5Z)-4-bromo-5-(bromomethylidene)-2-oxo-3-furanyl]butyl ester IUPAC Name: 1-[(5Z)-4-bromo-5-(bromomethylidene)-2-oxofuran-3-yl]butyl octadecanoate Traditional Name: stearic acid 1-[(5Z)-4-bromo-5-(bromomethylene)-2-keto-3-furyl]butyl ester Formula: C27H44Br2O4 MolecularWeight: 592.44386

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CCC)C1=C(C(=CBr)OC1=O)Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OC(CCC)C1=C(/C(=C/Br)/OC1=O)Br

InChI

InChI=1S/C27H44Br2O4/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-24(30)32-22(19-4-2)25-26(29)23(21-28)33-27(25)31/h21-22H,3-20H2,1-2H3/b23-21-