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

Systemtic Name: 2-[(4-bromanyl-3-chloranyl-phenyl)methyl]-5-chloranyl-4-phenyl-1H-pyrazol-3-one Openeye Name: 2-[(4-bromo-3-chloro-phenyl)methyl]-5-chloro-4-phenyl-1H-pyrazol-3-one CAS Name: 2-[(4-bromo-3-chlorophenyl)methyl]-5-chloro-4-phenyl-1H-pyrazol-3-one IUPAC Name: 2-[(4-bromo-3-chlorophenyl)methyl]-5-chloro-4-phenyl-1H-pyrazol-3-one Traditional Name: 2-(4-bromo-3-chloro-benzyl)-5-chloro-4-phenyl-3-pyrazolin-3-one Formula: C16H11BrCl2N2O MolecularWeight: 398.08134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(NN(C2=O)CC3=CC(=C(C=C3)Br)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(NN(C2=O)CC3=CC(=C(C=C3)Br)Cl)Cl

InChI

InChI=1S/C16H11BrCl2N2O/c17-12-7-6-10(8-13(12)18)9-21-16(22)14(15(19)20-21)11-4-2-1-3-5-11/h1-8,20H,9H2