4-[(4Z)-4-[(2-chloranyl-4-methyl-phenyl)hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[(4Z)-4-[(2-chloranyl-4-methyl-phenyl)hydrazinylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]benzoic acid Openeye Name: 4-[(4Z)-4-[(2-chloro-4-methyl-phenyl)hydrazono]-3-methyl-5-oxo-pyrazol-1-yl]benzoic acid CAS Name: 4-[(4Z)-4-[(2-chloro-4-methylphenyl)hydrazinylidene]-3-methyl-5-oxo-1-pyrazolyl]benzoic acid IUPAC Name: 4-[(4Z)-4-[(2-chloro-4-methylphenyl)hydrazinylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid Traditional Name: 4-[(4Z)-4-[(2-chloro-4-methyl-phenyl)hydrazono]-5-keto-3-methyl-2-pyrazolin-1-yl]benzoic acid Formula: C18H15ClN4O3 MolecularWeight: 370.7897

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NN=C2C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)N/N=C\2/C(=NN(C2=O)C3=CC=C(C=C3)C(=O)O)C)Cl

InChI

InChI=1S/C18H15ClN4O3/c1-10-3-8-15(14(19)9-10)20-21-16-11(2)22-23(17(16)24)13-6-4-12(5-7-13)18(25)26/h3-9,20H,1-2H3,(H,25,26)/b21-16-