2-chloranyl-5-[[(4R)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylideneamino]benzoate

Systemtic Name: 2-chloranyl-5-[[(4R)-3-methyl-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl]methylideneamino]benzoate Openeye Name: 2-chloro-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methyleneamino]benzoate CAS Name: 2-chloro-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylideneamino]benzoate IUPAC Name: 2-chloro-5-[[(4R)-3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl]methylideneamino]benzoate Traditional Name: 2-chloro-5-[[(4R)-5-keto-3-methyl-1-phenyl-2-pyrazolin-4-yl]methyleneamino]benzoate Formula: C18H13ClN3O3- MolecularWeight: 354.76712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1C=NC2=CC(=C(C=C2)Cl)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)[C@@H]1C=NC2=CC(=C(C=C2)Cl)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H14ClN3O3/c1-11-15(17(23)22(21-11)13-5-3-2-4-6-13)10-20-12-7-8-16(19)14(9-12)18(24)25/h2-10,15H,1H3,(H,24,25)/p-1/t15-/m1/s1