5-bromanyl-3-[[1-(octadecylcarbamoyloxymethyl)cyclopentyl]methyl]pentanoate

Systemtic Name: 5-bromanyl-3-[[1-(octadecylcarbamoyloxymethyl)cyclopentyl]methyl]pentanoate Openeye Name: 5-bromo-3-[[1-(octadecylcarbamoyloxymethyl)cyclopentyl]methyl]pentanoate CAS Name: 5-bromo-3-[[1-[[(octadecylamino)-oxomethoxy]methyl]cyclopentyl]methyl]pentanoate IUPAC Name: 5-bromo-3-[[1-(octadecylcarbamoyloxymethyl)cyclopentyl]methyl]pentanoate Traditional Name: 5-bromo-3-[[1-(stearylcarbamoyloxymethyl)cyclopentyl]methyl]valerate Formula: C31H57BrNO4- MolecularWeight: 587.69258

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCCC1)CC(CCBr)CC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC1(CCCC1)CC(CCBr)CC(=O)[O-]

InChI

InChI=1S/C31H58BrNO4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-24-33-30(36)37-27-31(21-17-18-22-31)26-28(20-23-32)25-29(34)35/h28H,2-27H2,1H3,(H,33,36)(H,34,35)/p-1