(2S)-3-methyl-2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: (2S)-3-methyl-2-[4,5,6,7-tetrakis(chloranyl)-1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: (2S)-3-methyl-2-(4,5,6,7-tetrachloro-1,3-dioxo-isoindolin-2-yl)butanoate CAS Name: (2S)-3-methyl-2-(4,5,6,7-tetrachloro-1,3-dioxo-2-isoindolyl)butanoate IUPAC Name: (2S)-3-methyl-2-(4,5,6,7-tetrachloro-1,3-dioxoisoindol-2-yl)butanoate Traditional Name: (2S)-3-methyl-2-(4,5,6,7-tetrachloro-1,3-diketo-isoindolin-2-yl)butyrate Formula: C13H8Cl4NO4- MolecularWeight: 384.01892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)[O-])N1C(=O)C2=C(C1=O)C(=C(C(=C2Cl)Cl)Cl)Cl

InChI

InChI=1S/C13H9Cl4NO4/c1-3(2)10(13(21)22)18-11(19)4-5(12(18)20)7(15)9(17)8(16)6(4)14/h3,10H,1-2H3,(H,21,22)/p-1/t10-/m0/s1