methyl 3-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate

Systemtic Name: methyl 3-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate Openeye Name: methyl 3-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate CAS Name: 3-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate Traditional Name: 3-[4,6-bis(trichloromethyl)-s-triazin-2-yl]benzoic acid methyl ester Formula: C13H7Cl6N3O2 MolecularWeight: 449.93158

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC(=C1)C2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

Isomeric SMILES

COC(=O)C1=CC=CC(=C1)C2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H7Cl6N3O2/c1-24-9(23)7-4-2-3-6(5-7)8-20-10(12(14,15)16)22-11(21-8)13(17,18)19/h2-5H,1H3