2-[2-[1-(4-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzoic acid

Systemtic Name: 2-[2-[1-(4-chlorophenyl)-3-methyl-5-oxidanylidene-pyrazol-4-ylidene]hydrazinyl]benzoic acid Openeye Name: 2-[2-[1-(4-chlorophenyl)-3-methyl-5-oxo-pyrazol-4-ylidene]hydrazino]benzoic acid CAS Name: 2-[2-[1-(4-chlorophenyl)-3-methyl-5-oxo-4-pyrazolylidene]hydrazinyl]benzoic acid IUPAC Name: 2-[2-[1-(4-chlorophenyl)-3-methyl-5-oxopyrazol-4-ylidene]hydrazinyl]benzoic acid Traditional Name: 2-[N'-[1-(4-chlorophenyl)-5-keto-3-methyl-2-pyrazolin-4-ylidene]hydrazino]benzoic acid Formula: C17H13ClN4O3 MolecularWeight: 356.76312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=O)C1=NNC2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H13ClN4O3/c1-10-15(20-19-14-5-3-2-4-13(14)17(24)25)16(23)22(21-10)12-8-6-11(18)7-9-12/h2-9,19H,1H3,(H,24,25)