2-(4-chloranyl-2-ethyl-pyrazol-3-yl)quinoline-4-carboxylic acid

Systemtic Name: 2-(4-chloranyl-2-ethyl-pyrazol-3-yl)quinoline-4-carboxylic acid Openeye Name: 2-(4-chloro-2-ethyl-pyrazol-3-yl)quinoline-4-carboxylic acid CAS Name: 2-(4-chloro-2-ethyl-3-pyrazolyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-chloro-2-ethylpyrazol-3-yl)quinoline-4-carboxylic acid Traditional Name: 2-(4-chloro-2-ethyl-pyrazol-3-yl)cinchoninic acid Formula: C15H12ClN3O2 MolecularWeight: 301.72768

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Cl)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CCN1C(=C(C=N1)Cl)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C15H12ClN3O2/c1-2-19-14(11(16)8-17-19)13-7-10(15(20)21)9-5-3-4-6-12(9)18-13/h3-8H,2H2,1H3,(H,20,21)