2-methyl-6-propyl-3-[1,1,2,2-tetrakis(chloranyl)ethylsulfanyl]-2H-1,3-benzoxazin-4-one

Systemtic Name: 2-methyl-6-propyl-3-[1,1,2,2-tetrakis(chloranyl)ethylsulfanyl]-2H-1,3-benzoxazin-4-one Openeye Name: 2-methyl-6-propyl-3-(1,1,2,2-tetrachloroethylsulfanyl)-2H-1,3-benzoxazin-4-one CAS Name: 2-methyl-6-propyl-3-(1,1,2,2-tetrachloroethylthio)-2H-1,3-benzoxazin-4-one IUPAC Name: 2-methyl-6-propyl-3-(1,1,2,2-tetrachloroethylsulfanyl)-2H-1,3-benzoxazin-4-one Traditional Name: 2-methyl-6-propyl-3-(1,1,2,2-tetrachloroethylthio)-2H-1,3-benzoxazin-4-one Formula: C14H15Cl4NO2S MolecularWeight: 403.1514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(C=C1)OC(N(C2=O)SC(C(Cl)Cl)(Cl)Cl)C

Isomeric SMILES

CCCC1=CC2=C(C=C1)OC(N(C2=O)SC(C(Cl)Cl)(Cl)Cl)C

InChI

InChI=1S/C14H15Cl4NO2S/c1-3-4-9-5-6-11-10(7-9)12(20)19(8(2)21-11)22-14(17,18)13(15)16/h5-8,13H,3-4H2,1-2H3