4-azanyl-1-methyl-5-phenyl-2-[2,4,6-tris(chloranyl)phenyl]pyrazol-3-one

Systemtic Name: 4-azanyl-1-methyl-5-phenyl-2-[2,4,6-tris(chloranyl)phenyl]pyrazol-3-one Openeye Name: 4-amino-1-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)pyrazol-3-one CAS Name: 4-amino-1-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-3-pyrazolone IUPAC Name: 4-amino-1-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)pyrazol-3-one Traditional Name: 4-amino-1-methyl-5-phenyl-2-(2,4,6-trichlorophenyl)-3-pyrazolin-3-one Formula: C16H12Cl3N3O MolecularWeight: 368.64498

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=O)N1C2=C(C=C(C=C2Cl)Cl)Cl)N)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=O)N1C2=C(C=C(C=C2Cl)Cl)Cl)N)C3=CC=CC=C3

InChI

InChI=1S/C16H12Cl3N3O/c1-21-14(9-5-3-2-4-6-9)13(20)16(23)22(21)15-11(18)7-10(17)8-12(15)19/h2-8H,20H2,1H3