8-(6-chloranyl-3-oxidanyl-4-oxidanylidene-chromen-2-yl)-4H-1,3-benzodioxine-6-carboxylate

Systemtic Name: 8-(6-chloranyl-3-oxidanyl-4-oxidanylidene-chromen-2-yl)-4H-1,3-benzodioxine-6-carboxylate Openeye Name: 8-(6-chloro-3-hydroxy-4-oxo-chromen-2-yl)-4H-1,3-benzodioxine-6-carboxylate CAS Name: 8-(6-chloro-3-hydroxy-4-oxo-1-benzopyran-2-yl)-4H-1,3-benzodioxin-6-carboxylate IUPAC Name: 8-(6-chloro-3-hydroxy-4-oxochromen-2-yl)-4H-1,3-benzodioxine-6-carboxylate Traditional Name: 8-(6-chloro-3-hydroxy-4-keto-chromen-2-yl)-4H-1,3-benzodioxin-6-carboxylate Formula: C18H10ClO7- MolecularWeight: 373.7208

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)C(=O)[O-])C3=C(C(=O)C4=C(O3)C=CC(=C4)Cl)O)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)C(=O)[O-])C3=C(C(=O)C4=C(O3)C=CC(=C4)Cl)O)OCO1

InChI

InChI=1S/C18H11ClO7/c19-10-1-2-13-11(5-10)14(20)15(21)17(26-13)12-4-8(18(22)23)3-9-6-24-7-25-16(9)12/h1-5,21H,6-7H2,(H,22,23)/p-1