sodium 3-(4-methylphenyl)-2-oxidanyl-propane-1-thiolate

Systemtic Name: sodium 3-(4-methylphenyl)-2-oxidanyl-propane-1-thiolate Openeye Name: sodium 2-hydroxy-3-(p-tolyl)propane-1-thiolate CAS Name: sodium 2-hydroxy-3-(4-methylphenyl)-1-propanethiolate IUPAC Name: sodium 2-hydroxy-3-(4-methylphenyl)propane-1-thiolate Traditional Name: sodium 2-hydroxy-3-(p-tolyl)propane-1-thiolate Formula: C10H13NaOS MolecularWeight: 204.26439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C[S-])O.[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)CC(C[S-])O.[Na+]

InChI

InChI=1S/C10H14OS.Na/c1-8-2-4-9(5-3-8)6-10(11)7-12;/h2-5,10-12H,6-7H2,1H3;/q;+1/p-1