[4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[(E)-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] 4-fluoranylbenzoate Openeye Name: [4-[(E)-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methyl]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[(E)-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methyl]phenyl] ester IUPAC Name: [4-[(E)-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methyl]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[(E)-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methyl]phenyl] ester Formula: C24H17FN2O3 MolecularWeight: 400.401783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C24H17FN2O3/c1-16-22(23(28)27(26-16)20-5-3-2-4-6-20)15-17-7-13-21(14-8-17)30-24(29)18-9-11-19(25)12-10-18/h2-15H,1H3/b22-15+