[2,3,5-tris(chloranyl)-4,6-dicyano-phenyl] 2-ethylhexanoate

Systemtic Name: [2,3,5-tris(chloranyl)-4,6-dicyano-phenyl] 2-ethylhexanoate Openeye Name: (2,3,5-trichloro-4,6-dicyano-phenyl) 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid (2,3,5-trichloro-4,6-dicyanophenyl) ester IUPAC Name: (2,3,5-trichloro-4,6-dicyanophenyl) 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid (2,3,5-trichloro-4,6-dicyano-phenyl) ester Formula: C16H15Cl3N2O2 MolecularWeight: 373.6615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)C#N

Isomeric SMILES

CCCCC(CC)C(=O)OC1=C(C(=C(C(=C1Cl)Cl)C#N)Cl)C#N

InChI

InChI=1S/C16H15Cl3N2O2/c1-3-5-6-9(4-2)16(22)23-15-11(8-21)12(17)10(7-20)13(18)14(15)19/h9H,3-6H2,1-2H3