2-chloranyl-5-[(4Z)-4-[(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoate

Systemtic Name: 2-chloranyl-5-[(4Z)-4-[(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylidene]-3-methylidene-5-oxidanylidene-pyrazolidin-1-yl]benzoate Openeye Name: 2-chloro-5-[(4Z)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylene]-3-methylene-5-oxo-pyrazolidin-1-yl]benzoate CAS Name: 2-chloro-5-[(4Z)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]-3-methylene-5-oxo-1-pyrazolidinyl]benzoate IUPAC Name: 2-chloro-5-[(4Z)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]-3-methylidene-5-oxopyrazolidin-1-yl]benzoate Traditional Name: 2-chloro-5-[(4Z)-5-keto-4-[(2-keto-7-methoxy-1,3-benzoxathiol-5-yl)methylene]-3-methylene-pyrazolidin-1-yl]benzoate Formula: C20H12ClN2O6S- MolecularWeight: 443.83708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)C=C3C(=C)NN(C3=O)C4=CC(=C(C=C4)Cl)C(=O)[O-])SC(=O)O2

Isomeric SMILES

COC1=C2C(=CC(=C1)/C=C\3/C(=C)NN(C3=O)C4=CC(=C(C=C4)Cl)C(=O)[O-])SC(=O)O2

InChI

InChI=1S/C20H13ClN2O6S/c1-9-12(5-10-6-15(28-2)17-16(7-10)30-20(27)29-17)18(24)23(22-9)11-3-4-14(21)13(8-11)19(25)26/h3-8,22H,1H2,2H3,(H,25,26)/p-1/b12-5-