2-(2,4-dichlorophenyl)-4-methyl-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 2-(2,4-dichlorophenyl)-4-methyl-3-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-5-carboxylic acid Openeye Name: 2-(2,4-dichlorophenyl)-4-methyl-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-5-carboxylic acid CAS Name: 2-(2,4-dichlorophenyl)-4-methyl-3-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrazole-5-carboxylic acid IUPAC Name: 2-(2,4-dichlorophenyl)-4-methyl-3-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrazole-5-carboxylic acid Traditional Name: 1-(2,4-dichlorophenyl)-5-(4-ketocyclohexa-2,5-dien-1-ylidene)-4-methyl-3-pyrazoline-3-carboxylic acid Formula: C17H12Cl2N2O3 MolecularWeight: 363.19478

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12Cl2N2O3/c1-9-15(17(23)24)20-21(14-7-4-11(18)8-13(14)19)16(9)10-2-5-12(22)6-3-10/h2-8,20H,1H3,(H,23,24)