2-(4-chloranyl-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one

Systemtic Name: 2-(4-chloranyl-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one Openeye Name: 2-(4-chloro-2-nitro-phenyl)-3-methyl-1H-pyrazol-5-one CAS Name: 2-(4-chloro-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one IUPAC Name: 2-(4-chloro-2-nitrophenyl)-3-methyl-1H-pyrazol-5-one Traditional Name: 1-(4-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)NN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)NN1C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

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