[(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] 2,2,2-tris(bromanyl)ethanoate

Systemtic Name: [(E)-2-azanyl-3-oxidanyl-octadec-4-enyl] 2,2,2-tris(bromanyl)ethanoate Openeye Name: [(E)-2-amino-3-hydroxy-octadec-4-enyl] 2,2,2-tribromoacetate CAS Name: 2,2,2-tribromoacetic acid [(E)-2-amino-3-hydroxyoctadec-4-enyl] ester IUPAC Name: [(E)-2-amino-3-hydroxyoctadec-4-enyl] 2,2,2-tribromoacetate Traditional Name: 2,2,2-tribromoacetic acid [(E)-2-amino-3-hydroxy-octadec-4-enyl] ester Formula: C20H36Br3NO3 MolecularWeight: 578.21674

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC=CC(C(COC(=O)C(Br)(Br)Br)N)O

Isomeric SMILES

CCCCCCCCCCCCC/C=C/C(C(COC(=O)C(Br)(Br)Br)N)O

InChI

InChI=1S/C20H36Br3NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(25)17(24)16-27-19(26)20(21,22)23/h14-15,17-18,25H,2-13,16,24H2,1H3/b15-14+