calcium 2-butoxycarbothioylsulfanylethanoate

Systemtic Name: calcium 2-butoxycarbothioylsulfanylethanoate Openeye Name: calcium 2-butoxycarbothioylsulfanylacetate CAS Name: calcium 2-[[butoxy(sulfanylidene)methyl]thio]acetate IUPAC Name: calcium 2-butoxycarbothioylsulfanylacetate Traditional Name: calcium 2-(butoxycarbothioylthio)acetate Formula: C7H11CaO3S2+ MolecularWeight: 247.36844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=S)SCC(=O)[O-].[Ca+2]

Isomeric SMILES

CCCCOC(=S)SCC(=O)[O-].[Ca+2]

InChI

InChI=1S/C7H12O3S2.Ca/c1-2-3-4-10-7(11)12-5-6(8)9;/h2-5H2,1H3,(H,8,9);/q;+2/p-1