2-(3,5-dimethylpyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(3,5-dimethylpyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(3,5-dimethylpyrazol-1-yl)-3-methyl-quinoline-4-carboxylic acid CAS Name: 2-(3,5-dimethyl-1-pyrazolyl)-3-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(3,5-dimethylpyrazol-1-yl)-3-methylquinoline-4-carboxylic acid Traditional Name: 2-(3,5-dimethylpyrazol-1-yl)-3-methyl-cinchoninic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=CC=CC=C3C(=C2C)C(=O)O)C

Isomeric SMILES

CC1=CC(=NN1C2=NC3=CC=CC=C3C(=C2C)C(=O)O)C

InChI

InChI=1S/C16H15N3O2/c1-9-8-10(2)19(18-9)15-11(3)14(16(20)21)12-6-4-5-7-13(12)17-15/h4-8H,1-3H3,(H,20,21)