4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one

Systemtic Name: 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Openeye Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-(3-nitrophenyl)oxazol-5-one CAS Name: 4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]-2-(3-nitrophenyl)-5-oxazolone IUPAC Name: 4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(3-nitrophenyl)-1,3-oxazol-5-one Traditional Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-(3-nitrophenyl)-2-oxazolin-5-one Formula: C20H13ClN4O4 MolecularWeight: 408.79462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C=C2C(=O)OC(=N2)C3=CC(=CC=C3)[N+](=O)[O-])Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H13ClN4O4/c1-12-16(18(21)24(23-12)14-7-3-2-4-8-14)11-17-20(26)29-19(22-17)13-6-5-9-15(10-13)25(27)28/h2-11H,1H3