8-methyl-2-(6-methylheptoxy)-2-(2-oxidanidyl-1-oxidanyl-2-oxidanylidene-ethyl)sulfanyl-nonanoate; sulfane

Systemtic Name: 8-methyl-2-(6-methylheptoxy)-2-(2-oxidanidyl-1-oxidanyl-2-oxidanylidene-ethyl)sulfanyl-nonanoate; sulfane Openeye Name: hydrogen sulfide; 2-(1-hydroxy-2-oxido-2-oxo-ethyl)sulfanyl-8-methyl-2-(6-methylheptoxy)nonanoate CAS Name: 2-[(1-hydroxy-2-oxido-2-oxoethyl)thio]-8-methyl-2-(6-methylheptoxy)nonanoate; sulfane IUPAC Name: 2-(1-hydroxy-2-oxido-2-oxoethyl)sulfanyl-8-methyl-2-(6-methylheptoxy)nonanoate; sulfane Traditional Name: hydrogen sulfide; 2-[(1-hydroxy-2-keto-2-oxido-ethyl)thio]-8-methyl-2-(6-methylheptoxy)pelargonate Formula: C20H38O6S2-2 MolecularWeight: 438.64212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCC(C(=O)[O-])(OCCCCCC(C)C)SC(C(=O)[O-])O.S

Isomeric SMILES

CC(C)CCCCCC(C(=O)[O-])(OCCCCCC(C)C)SC(C(=O)[O-])O.S

InChI

InChI=1S/C20H38O6S.H2S/c1-15(2)11-7-5-9-13-20(19(24)25,27-18(23)17(21)22)26-14-10-6-8-12-16(3)4;/h15-16,18,23H,5-14H2,1-4H3,(H,21,22)(H,24,25);1H2/p-2