2-bromanyl-3-octadecyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazolidin-4-one

Systemtic Name: 2-bromanyl-3-octadecyl-1-[2,4,6-tris(chloranyl)phenyl]pyrazolidin-4-one Openeye Name: 2-bromo-3-octadecyl-1-(2,4,6-trichlorophenyl)pyrazolidin-4-one CAS Name: 2-bromo-3-octadecyl-1-(2,4,6-trichlorophenyl)-4-pyrazolidinone IUPAC Name: 2-bromo-3-octadecyl-1-(2,4,6-trichlorophenyl)pyrazolidin-4-one Traditional Name: 2-bromo-3-stearyl-1-(2,4,6-trichlorophenyl)pyrazolidin-4-one Formula: C27H42BrCl3N2O MolecularWeight: 596.89818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC1C(=O)CN(N1Br)C2=C(C=C(C=C2Cl)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC1C(=O)CN(N1Br)C2=C(C=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C27H42BrCl3N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-26(34)21-32(33(25)28)27-23(30)19-22(29)20-24(27)31/h19-20,25H,2-18,21H2,1H3