2,3-bis(sulfanyl)butanedioic acid; carbon monoxide; 1-isocyano-2-methoxy-2-methyl-propane; technetium-99

Systemtic Name: 2,3-bis(sulfanyl)butanedioic acid; carbon monoxide; 1-isocyano-2-methoxy-2-methyl-propane; technetium-99 Openeye Name: 2,3-bis(sulfanyl)butanedioic acid; carbon monoxide; 1-isocyano-2-methoxy-2-methyl-propane; technetium-99 CAS Name: carbon monoxide; 2,3-dimercaptobutanedioic acid; 1-isocyano-2-methoxy-2-methylpropane; technetium-99 IUPAC Name: 2,3-bis(sulfanyl)butanedioic acid; carbon monoxide; 1-isocyano-2-methoxy-2-methylpropane; technetium-99 Traditional Name: carbon monoxide; 2,3-dimercaptosuccinic acid; 1-isocyano-2-methoxy-2-methyl-propane; technetium-99 Formula: C13H17NO8S2Tc MolecularWeight: 478.312235

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C[N+]#[C-])OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].C(C(C(=O)O)S)(C(=O)O)S.[Tc]

Isomeric SMILES

CC(C)(C[N+]#[C-])OC.[C-]#[O+].[C-]#[O+].[C-]#[O+].C(C(C(=O)O)S)(C(=O)O)S.[99Tc]

InChI

InChI=1S/C6H11NO.C4H6O4S2.3CO.Tc/c1-6(2,8-4)5-7-3;5-3(6)1(9)2(10)4(7)8;3*1-2;/h5H2,1-2,4H3;1-2,9-10H,(H,5,6)(H,7,8);;;;/i;;;;;1+1