5-(5-chloranylindol-3-ylidene)-1,2-dihydropyrazole-3-carboxylic acid

Systemtic Name: 5-(5-chloranylindol-3-ylidene)-1,2-dihydropyrazole-3-carboxylic acid Openeye Name: 5-(5-chloroindol-3-ylidene)-1,2-dihydropyrazole-3-carboxylic acid CAS Name: 5-(5-chloro-3-indolylidene)-1,2-dihydropyrazole-3-carboxylic acid IUPAC Name: 5-(5-chloroindol-3-ylidene)-1,2-dihydropyrazole-3-carboxylic acid Traditional Name: 5-(5-chloroindol-3-ylidene)-3-pyrazoline-3-carboxylic acid Formula: C12H8ClN3O2 MolecularWeight: 261.66382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=C3C=C(NN3)C(=O)O)C=N2

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=C3C=C(NN3)C(=O)O)C=N2

InChI

InChI=1S/C12H8ClN3O2/c13-6-1-2-9-7(3-6)8(5-14-9)10-4-11(12(17)18)16-15-10/h1-5,15-16H,(H,17,18)