1-(3-chlorophenyl)-4-[(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: 1-(3-chlorophenyl)-4-[(7-methoxy-2-oxidanylidene-1,3-benzoxathiol-5-yl)methylidene]pyrazolidine-3,5-dione Openeye Name: 1-(3-chlorophenyl)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylene]pyrazolidine-3,5-dione CAS Name: 1-(3-chlorophenyl)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]pyrazolidine-3,5-dione IUPAC Name: 1-(3-chlorophenyl)-4-[(7-methoxy-2-oxo-1,3-benzoxathiol-5-yl)methylidene]pyrazolidine-3,5-dione Traditional Name: 1-(3-chlorophenyl)-4-[(2-keto-7-methoxy-1,3-benzoxathiol-5-yl)methylene]pyrazolidine-3,5-quinone Formula: C18H11ClN2O5S MolecularWeight: 402.80834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H11ClN2O5S/c1-25-13-6-9(7-14-15(13)26-18(24)27-14)5-12-16(22)20-21(17(12)23)11-4-2-3-10(19)8-11/h2-8H,1H3,(H,20,22)