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

Systemtic Name: 5-azanyl-2-[[3,4-bis(chloranyl)-2-methyl-phenyl]methyl]-4H-pyrazol-3-one Openeye Name: 5-amino-2-[(3,4-dichloro-2-methyl-phenyl)methyl]-4H-pyrazol-3-one CAS Name: 5-amino-2-[(3,4-dichloro-2-methylphenyl)methyl]-4H-pyrazol-3-one IUPAC Name: 5-amino-2-[(3,4-dichloro-2-methylphenyl)methyl]-4H-pyrazol-3-one Traditional Name: 5-amino-2-(3,4-dichloro-2-methyl-benzyl)-2-pyrazolin-3-one Formula: C11H11Cl2N3O MolecularWeight: 272.13054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1Cl)Cl)CN2C(=O)CC(=N2)N

Isomeric SMILES

CC1=C(C=CC(=C1Cl)Cl)CN2C(=O)CC(=N2)N

InChI

InChI=1S/C11H11Cl2N3O/c1-6-7(2-3-8(12)11(6)13)5-16-10(17)4-9(14)15-16/h2-3H,4-5H2,1H3,(H2,14,15)