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

Systemtic Name: 5-azanyl-2-[(3-bromanyl-4-chloranyl-phenyl)methyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[(3-bromo-4-chloro-phenyl)methyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[(3-bromo-4-chlorophenyl)methyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[(3-bromo-4-chlorophenyl)methyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-(3-bromo-4-chloro-benzyl)-3-pyrazolin-3-one Formula: C10H9BrClN3O MolecularWeight: 302.55496

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CN2C(=O)C=C(N2)N)Br)Cl

Isomeric SMILES

C1=CC(=C(C=C1CN2C(=O)C=C(N2)N)Br)Cl

InChI

InChI=1S/C10H9BrClN3O/c11-7-3-6(1-2-8(7)12)5-15-10(16)4-9(13)14-15/h1-4,14H,5,13H2