2-(3-chlorophenyl)-5-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-propyl-1H-pyrazole-4-carboxylic acid

Systemtic Name: 2-(3-chlorophenyl)-5-(3-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3-propyl-1H-pyrazole-4-carboxylic acid Openeye Name: 2-(3-chlorophenyl)-5-(3-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3-propyl-1H-pyrazole-4-carboxylic acid CAS Name: 2-(3-chlorophenyl)-5-(3-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)-3-propyl-1H-pyrazole-4-carboxylic acid IUPAC Name: 2-(3-chlorophenyl)-5-(3-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)-3-propyl-1H-pyrazole-4-carboxylic acid Traditional Name: 1-(3-chlorophenyl)-3-(3-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)-5-propyl-3-pyrazoline-4-carboxylic acid Formula: C19H17ClN2O4 MolecularWeight: 372.80228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C2C=CC(=O)C(=C2)O)NN1C3=CC(=CC=C3)Cl)C(=O)O

Isomeric SMILES

CCCC1=C(C(=C2C=CC(=O)C(=C2)O)NN1C3=CC(=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C19H17ClN2O4/c1-2-4-14-17(19(25)26)18(11-7-8-15(23)16(24)9-11)21-22(14)13-6-3-5-12(20)10-13/h3,5-10,21,24H,2,4H2,1H3,(H,25,26)