sodium 3-(4-bromanylthiophen-3-yl)prop-2-ynyl sulfate

Systemtic Name: sodium 3-(4-bromanylthiophen-3-yl)prop-2-ynyl sulfate Openeye Name: sodium 3-(4-bromo-3-thienyl)prop-2-ynyl sulfate CAS Name: sodium 3-(4-bromo-3-thiophenyl)prop-2-ynyl sulfate IUPAC Name: sodium 3-(4-bromothiophen-3-yl)prop-2-ynyl sulfate Traditional Name: sodium 3-(4-bromo-3-thienyl)prop-2-ynyl sulfate Formula: C7H4BrNaO4S2 MolecularWeight: 319.12803

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CS1)Br)C#CCOS(=O)(=O)[O-].[Na+]

Isomeric SMILES

C1=C(C(=CS1)Br)C#CCOS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C7H5BrO4S2.Na/c8-7-5-13-4-6(7)2-1-3-12-14(9,10)11;/h4-5H,3H2,(H,9,10,11);/q;+1/p-1