2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid CAS Name: 2-(4-chloro-3,5-dimethyl-1-pyrazolyl)-3-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(4-chloro-3,5-dimethylpyrazol-1-yl)-3-methylquinoline-4-carboxylic acid Traditional Name: 2-(4-chloro-3,5-dimethyl-pyrazol-1-yl)-3-methyl-cinchoninic acid Formula: C16H14ClN3O2 MolecularWeight: 315.75426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N=C1N3C(=C(C(=N3)C)Cl)C)C(=O)O

Isomeric SMILES

CC1=C(C2=CC=CC=C2N=C1N3C(=C(C(=N3)C)Cl)C)C(=O)O

InChI

InChI=1S/C16H14ClN3O2/c1-8-13(16(21)22)11-6-4-5-7-12(11)18-15(8)20-10(3)14(17)9(2)19-20/h4-7H,1-3H3,(H,21,22)