sodium 2-[2-[3,5-bis(bromanyl)thiophen-2-yl]-4-oxidanylidene-chromen-8-yl]ethanoate

Systemtic Name: sodium 2-[2-[3,5-bis(bromanyl)thiophen-2-yl]-4-oxidanylidene-chromen-8-yl]ethanoate Openeye Name: sodium 2-[2-(3,5-dibromo-2-thienyl)-4-oxo-chromen-8-yl]acetate CAS Name: sodium 2-[2-(3,5-dibromo-2-thiophenyl)-4-oxo-1-benzopyran-8-yl]acetate IUPAC Name: sodium 2-[2-(3,5-dibromothiophen-2-yl)-4-oxochromen-8-yl]acetate Traditional Name: sodium 2-[2-(3,5-dibromo-2-thienyl)-4-keto-chromen-8-yl]acetate Formula: C15H7Br2NaO4S MolecularWeight: 466.07645

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CC(=O)[O-])OC(=CC2=O)C3=C(C=C(S3)Br)Br.[Na+]

Isomeric SMILES

C1=CC2=C(C(=C1)CC(=O)[O-])OC(=CC2=O)C3=C(C=C(S3)Br)Br.[Na+]

InChI

InChI=1S/C15H8Br2O4S.Na/c16-9-5-12(17)22-15(9)11-6-10(18)8-3-1-2-7(4-13(19)20)14(8)21-11;/h1-3,5-6H,4H2,(H,19,20);/q;+1/p-1