2-(2-ethylpyrazol-3-yl)-6-methyl-quinoline-4-carboxylic acid

Systemtic Name: 2-(2-ethylpyrazol-3-yl)-6-methyl-quinoline-4-carboxylic acid Openeye Name: 2-(2-ethylpyrazol-3-yl)-6-methyl-quinoline-4-carboxylic acid CAS Name: 2-(2-ethyl-3-pyrazolyl)-6-methyl-4-quinolinecarboxylic acid IUPAC Name: 2-(2-ethylpyrazol-3-yl)-6-methylquinoline-4-carboxylic acid Traditional Name: 2-(2-ethylpyrazol-3-yl)-6-methyl-cinchoninic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)O

Isomeric SMILES

CCN1C(=CC=N1)C2=NC3=C(C=C(C=C3)C)C(=C2)C(=O)O

InChI

InChI=1S/C16H15N3O2/c1-3-19-15(6-7-17-19)14-9-12(16(20)21)11-8-10(2)4-5-13(11)18-14/h4-9H,3H2,1-2H3,(H,20,21)