2-(5-chloranyl-2-nitro-phenyl)-5-methyl-1H-pyrazol-3-one

Systemtic Name: 2-(5-chloranyl-2-nitro-phenyl)-5-methyl-1H-pyrazol-3-one Openeye Name: 2-(5-chloro-2-nitro-phenyl)-5-methyl-1H-pyrazol-3-one CAS Name: 2-(5-chloro-2-nitrophenyl)-5-methyl-1H-pyrazol-3-one IUPAC Name: 2-(5-chloro-2-nitrophenyl)-5-methyl-1H-pyrazol-3-one Traditional Name: 2-(5-chloro-2-nitro-phenyl)-5-methyl-3-pyrazolin-3-one Formula: C10H8ClN3O3 MolecularWeight: 253.64182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)N(N1)C2=C(C=CC(=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H8ClN3O3/c1-6-4-10(15)13(12-6)9-5-7(11)2-3-8(9)14(16)17/h2-5,12H,1H3