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

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

Systemtic Name:sodium 2-[2-(3-methylthiophen-2-yl)-4-oxidanylidene-chromen-8-yl]ethanoate
Openeye Name:sodium 2-[2-(3-methyl-2-thienyl)-4-oxo-chromen-8-yl]acetate
CAS Name:sodium 2-[2-(3-methyl-2-thiophenyl)-4-oxo-1-benzopyran-8-yl]acetate
IUPAC Name:sodium 2-[2-(3-methylthiophen-2-yl)-4-oxochromen-8-yl]acetate
Traditional Name:sodium 2-[4-keto-2-(3-methyl-2-thienyl)chromen-8-yl]acetate
Formula: C16H11NaO4S
MolecularWeight: 322.31091
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2=CC(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-].[Na+]


Isomeric SMILES

CC1=C(SC=C1)C2=CC(=O)C3=C(O2)C(=CC=C3)CC(=O)[O-].[Na+]


InChI

InChI=1S/C16H12O4S.Na/c1-9-5-6-21-16(9)13-8-12(17)11-4-2-3-10(7-14(18)19)15(11)20-13;/h2-6,8H,7H2,1H3,(H,18,19);/q;+1/p-1


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