[(E)-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylideneamino] 4-fluoranylbenzoate

Systemtic Name: [(E)-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylideneamino] 4-fluoranylbenzoate Openeye Name: [(E)-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyleneamino] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [(E)-(5-chloro-1,3-dimethyl-4-pyrazolyl)methylideneamino] ester IUPAC Name: [(E)-(5-chloro-1,3-dimethylpyrazol-4-yl)methylideneamino] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [(E)-(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyleneamino] ester Formula: C13H11ClFN3O2 MolecularWeight: 295.696743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NOC(=O)C2=CC=C(C=C2)F)Cl)C

Isomeric SMILES

CC1=NN(C(=C1/C=N/OC(=O)C2=CC=C(C=C2)F)Cl)C

InChI

InChI=1S/C13H11ClFN3O2/c1-8-11(12(14)18(2)17-8)7-16-20-13(19)9-3-5-10(15)6-4-9/h3-7H,1-2H3/b16-7+