2,2,2-tris(chloranyl)ethyl (Z)-4-[3,3-bis(bromanyl)-2-oxidanylidene-1-sulfanidyl-azetidin-1-ium-1-yl]-3-methyl-but-3-enoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl (Z)-4-[3,3-bis(bromanyl)-2-oxidanylidene-1-sulfanidyl-azetidin-1-ium-1-yl]-3-methyl-but-3-enoate Openeye Name: 2,2,2-trichloroethyl (Z)-4-(3,3-dibromo-2-oxo-1-sulfido-azetidin-1-ium-1-yl)-3-methyl-but-3-enoate CAS Name: (Z)-4-(3,3-dibromo-2-oxo-1-sulfido-1-azetidin-1-iumyl)-3-methyl-3-butenoic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl (Z)-4-(3,3-dibromo-2-oxo-1-sulfidoazetidin-1-ium-1-yl)-3-methylbut-3-enoate Traditional Name: (Z)-4-(3,3-dibromo-2-keto-1-sulfido-azetidin-1-ium-1-yl)-3-methyl-but-3-enoic acid 2,2,2-trichloroethyl ester Formula: C10H10Br2Cl3NO3S MolecularWeight: 490.4233

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C[N+]1(CC(C1=O)(Br)Br)[S-])CC(=O)OCC(Cl)(Cl)Cl

Isomeric SMILES

C/C(=C/[N+]1(CC(C1=O)(Br)Br)[S-])/CC(=O)OCC(Cl)(Cl)Cl

InChI

InChI=1S/C10H10Br2Cl3NO3S/c1-6(2-7(17)19-5-10(13,14)15)3-16(20)4-9(11,12)8(16)18/h3H,2,4-5H2,1H3/b6-3-