(2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyimino-ethanamide; 2-(trichloromethylsulfanyl)isoindole-1,3-dione

Systemtic Name: (2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyimino-ethanamide; 2-(trichloromethylsulfanyl)isoindole-1,3-dione Openeye Name: (1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxo-acetimidoyl cyanide; 2-(trichloromethylsulfanyl)isoindoline-1,3-dione CAS Name: (2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyiminoacetamide; 2-(trichloromethylthio)isoindole-1,3-dione IUPAC Name: (1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide; 2-(trichloromethylsulfanyl)isoindole-1,3-dione Traditional Name: (2E)-2-cyano-N-(ethylcarbamoyl)-2-methyloximino-acetamide; 2-(trichloromethylthio)isoindoline-1,3-quinone Formula: C16H14Cl3N5O5S MolecularWeight: 494.73686

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(=NOC)C#N.C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl

Isomeric SMILES

CCNC(=O)NC(=O)/C(=N/OC)/C#N.C1=CC=C2C(=C1)C(=O)N(C2=O)SC(Cl)(Cl)Cl

InChI

InChI=1S/C9H4Cl3NO2S.C7H10N4O3/c10-9(11,12)16-13-7(14)5-3-1-2-4-6(5)8(13)15;1-3-9-7(13)10-6(12)5(4-8)11-14-2/h1-4H;3H2,1-2H3,(H2,9,10,12,13)/b;11-5+