sodium 2-[2-(5-bromanylthiophen-3-yl)-4-oxidanylidene-chromen-8-yl]ethanoate

Systemtic Name: sodium 2-[2-(5-bromanylthiophen-3-yl)-4-oxidanylidene-chromen-8-yl]ethanoate Openeye Name: sodium 2-[2-(5-bromo-3-thienyl)-4-oxo-chromen-8-yl]acetate CAS Name: sodium 2-[2-(5-bromo-3-thiophenyl)-4-oxo-1-benzopyran-8-yl]acetate IUPAC Name: sodium 2-[2-(5-bromothiophen-3-yl)-4-oxochromen-8-yl]acetate Traditional Name: sodium 2-[2-(5-bromo-3-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=CSC(=C3)Br.[Na+]

Isomeric SMILES

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

InChI

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