5-[[2,4-bis(chloranyl)phenoxy]methyl]-4-bromanyl-1-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 5-[[2,4-bis(chloranyl)phenoxy]methyl]-4-bromanyl-1-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-bromo-5-[(2,4-dichlorophenoxy)methyl]-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-bromo-5-[(2,4-dichlorophenoxy)methyl]-1-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-bromo-5-[(2,4-dichlorophenoxy)methyl]-1-methyl-2-phenylpyrazol-3-one Traditional Name: 4-bromo-5-[(2,4-dichlorophenoxy)methyl]-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C17H13BrCl2N2O2 MolecularWeight: 428.10732

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)COC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CN1C(=C(C(=O)N1C2=CC=CC=C2)Br)COC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H13BrCl2N2O2/c1-21-14(10-24-15-8-7-11(19)9-13(15)20)16(18)17(23)22(21)12-5-3-2-4-6-12/h2-9H,10H2,1H3