sodium 2-[2-(4-bromanylthiophen-2-yl)-4-oxidanylidene-chromen-8-yl]ethanoate

Systemtic Name: sodium 2-[2-(4-bromanylthiophen-2-yl)-4-oxidanylidene-chromen-8-yl]ethanoate Openeye Name: sodium 2-[2-(4-bromo-2-thienyl)-4-oxo-chromen-8-yl]acetate CAS Name: sodium 2-[2-(4-bromo-2-thiophenyl)-4-oxo-1-benzopyran-8-yl]acetate IUPAC Name: sodium 2-[2-(4-bromothiophen-2-yl)-4-oxochromen-8-yl]acetate Traditional Name: sodium 2-[2-(4-bromo-2-thienyl)-4-keto-chromen-8-yl]acetate Formula: C15H8BrNaO4S MolecularWeight: 387.18039

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CC(=O)[O-])OC(=CC2=O)C3=CC(=CS3)Br.[Na+]

Isomeric SMILES

C1=CC2=C(C(=C1)CC(=O)[O-])OC(=CC2=O)C3=CC(=CS3)Br.[Na+]

InChI

InChI=1S/C15H9BrO4S.Na/c16-9-5-13(21-7-9)12-6-11(17)10-3-1-2-8(4-14(18)19)15(10)20-12;/h1-3,5-7H,4H2,(H,18,19);/q;+1/p-1