4-[(1S)-1-(4-chlorophenyl)-2,2-dicyano-ethyl]-5-phenyl-1H-pyrazol-3-olate

Systemtic Name: 4-[(1S)-1-(4-chlorophenyl)-2,2-dicyano-ethyl]-5-phenyl-1H-pyrazol-3-olate Openeye Name: 4-[(1S)-1-(4-chlorophenyl)-2,2-dicyano-ethyl]-5-phenyl-1H-pyrazol-3-olate CAS Name: 4-[(1S)-1-(4-chlorophenyl)-2,2-dicyanoethyl]-5-phenyl-1H-pyrazol-3-olate IUPAC Name: 4-[(1S)-1-(4-chlorophenyl)-2,2-dicyanoethyl]-5-phenyl-1H-pyrazol-3-olate Traditional Name: 4-[(1S)-1-(4-chlorophenyl)-2,2-dicyano-ethyl]-5-phenyl-1H-pyrazol-3-olate Formula: C19H12ClN4O- MolecularWeight: 347.77778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=NN2)[O-])C(C3=CC=C(C=C3)Cl)C(C#N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=NN2)[O-])[C@H](C3=CC=C(C=C3)Cl)C(C#N)C#N

InChI

InChI=1S/C19H13ClN4O/c20-15-8-6-12(7-9-15)16(14(10-21)11-22)17-18(23-24-19(17)25)13-4-2-1-3-5-13/h1-9,14,16H,(H2,23,24,25)/p-1/t16-/m1/s1