2-azanidyl-3-methyl-3-sulfaniumyl-butanoate; copper; hydrate

Systemtic Name: 2-azanidyl-3-methyl-3-sulfaniumyl-butanoate; copper; hydrate Openeye Name: 2-azanidyl-3-methyl-3-sulfonio-butanoate; copper; hydrate CAS Name: 2-azanidyl-3-methyl-3-sulfaniumylbutanoate; copper; hydrate IUPAC Name: 2-azanidyl-3-methyl-3-sulfaniumylbutanoate; copper; hydrate Traditional Name: 2-amidyl-3-methyl-3-sulfonio-butyrate; copper; hydrate Formula: C5H12CuNO3S- MolecularWeight: 229.76468

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)[O-])[NH-])[SH2+].O.[Cu]

Isomeric SMILES

CC(C)(C(C(=O)[O-])[NH-])[SH2+].O.[Cu]

InChI

InChI=1S/C5H10NO2S.Cu.H2O/c1-5(2,9)3(6)4(7)8;;/h3,6,9H,1-2H3,(H,7,8);;1H2/q-1;;