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

Systemtic Name: butyl 4-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate Openeye Name: butyl 4-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate CAS Name: 4-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoic acid butyl ester IUPAC Name: butyl 4-[4,6-bis(trichloromethyl)-1,3,5-triazin-2-yl]benzoate Traditional Name: 4-[4,6-bis(trichloromethyl)-s-triazin-2-yl]benzoic acid butyl ester Formula: C16H13Cl6N3O2 MolecularWeight: 492.01132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13Cl6N3O2/c1-2-3-8-27-12(26)10-6-4-9(5-7-10)11-23-13(15(17,18)19)25-14(24-11)16(20,21)22/h4-7H,2-3,8H2,1H3