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

Systemtic Name: (4E)-4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylidene]-2-(3-iodanylphenyl)-1,3-oxazol-5-one Openeye Name: (4E)-4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-(3-iodophenyl)oxazol-5-one CAS Name: (4E)-4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylidene]-2-(3-iodophenyl)-5-oxazolone IUPAC Name: (4E)-4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylidene]-2-(3-iodophenyl)-1,3-oxazol-5-one Traditional Name: (4E)-4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methylene]-2-(3-iodophenyl)-2-oxazolin-5-one Formula: C20H13ClIN3O2 MolecularWeight: 489.69359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C2C(=O)OC(=N2)C3=CC(=CC=C3)I)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C/2\C(=O)OC(=N2)C3=CC(=CC=C3)I)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H13ClIN3O2/c1-12-16(18(21)25(24-12)15-8-3-2-4-9-15)11-17-20(26)27-19(23-17)13-6-5-7-14(22)10-13/h2-11H,1H3/b17-11+