1-(4-bromophenyl)-4-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione

Systemtic Name: 1-(4-bromophenyl)-4-[(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methylidene]pyrazolidine-3,5-dione Openeye Name: 1-(4-bromophenyl)-4-[(3-chloro-4-hydroxy-5-methoxy-phenyl)methylene]pyrazolidine-3,5-dione CAS Name: 1-(4-bromophenyl)-4-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]pyrazolidine-3,5-dione IUPAC Name: 1-(4-bromophenyl)-4-[(3-chloro-4-hydroxy-5-methoxyphenyl)methylidene]pyrazolidine-3,5-dione Traditional Name: 1-(4-bromophenyl)-4-(3-chloro-4-hydroxy-5-methoxy-benzylidene)pyrazolidine-3,5-quinone Formula: C17H12BrClN2O4 MolecularWeight: 423.64518

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C2C(=O)NN(C2=O)C3=CC=C(C=C3)Br)Cl)O

InChI

InChI=1S/C17H12BrClN2O4/c1-25-14-8-9(7-13(19)15(14)22)6-12-16(23)20-21(17(12)24)11-4-2-10(18)3-5-11/h2-8,22H,1H3,(H,20,23)