tricopper; (2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyimino-ethanamide; oxygen(2-); dichloride; hydrate

Systemtic Name: tricopper; (2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyimino-ethanamide; oxygen(2-); dichloride; hydrate Openeye Name: tricopper; (1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxo-acetimidoyl cyanide; oxygen(2-); dichloride; hydrate CAS Name: tricopper; (2E)-2-cyano-N-(ethylcarbamoyl)-2-methoxyiminoacetamide; oxygen(2-); dichloride; hydrate IUPAC Name: tricopper; (1E)-2-(ethylcarbamoylamino)-N-methoxy-2-oxoethanimidoyl cyanide; oxygen(2-); dichloride; hydrate Traditional Name: tricupric; (2E)-2-cyano-N-(ethylcarbamoyl)-2-methyloximino-acetamide; oxygen(2-); dichloride; hydrate Formula: C7H12Cl2Cu3N4O6 MolecularWeight: 509.73738

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(=NOC)C#N.O.[O-2].[O-2].[Cl-].[Cl-].[Cu+2].[Cu+2].[Cu+2]

Isomeric SMILES

CCNC(=O)NC(=O)/C(=N/OC)/C#N.O.[O-2].[O-2].[Cl-].[Cl-].[Cu+2].[Cu+2].[Cu+2]

InChI

InChI=1S/C7H10N4O3.2ClH.3Cu.H2O.2O/c1-3-9-7(13)10-6(12)5(4-8)11-14-2;;;;;;;;/h3H2,1-2H3,(H2,9,10,12,13);2*1H;;;;1H2;;/q;;;3*+2;;2*-2/p-2/b11-5+;;;;;;;;