propane; 3-sulfanylpropanoate

Systemtic Name: propane; 3-sulfanylpropanoate Openeye Name: propane; 3-sulfanylpropanoate CAS Name: 3-mercaptopropanoate; propane IUPAC Name: propane; 3-sulfanylpropanoate Traditional Name: 3-mercaptopropionate; n-propane Formula: C12H23O6S3-3 MolecularWeight: 359.50242

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Descriptors Computed from Structure

Canonical SMILES:

CCC.C(CS)C(=O)[O-].C(CS)C(=O)[O-].C(CS)C(=O)[O-]

Isomeric SMILES

CCC.C(CS)C(=O)[O-].C(CS)C(=O)[O-].C(CS)C(=O)[O-]

InChI

InChI=1S/3C3H6O2S.C3H8/c3*4-3(5)1-2-6;1-3-2/h3*6H,1-2H2,(H,4,5);3H2,1-2H3/p-3