5-propyl-1-quinolin-6-yl-pyrazole-4-carboxylic acid

Systemtic Name: 5-propyl-1-quinolin-6-yl-pyrazole-4-carboxylic acid Openeye Name: 5-propyl-1-(6-quinolyl)pyrazole-4-carboxylic acid CAS Name: 5-propyl-1-(6-quinolinyl)-4-pyrazolecarboxylic acid IUPAC Name: 5-propyl-1-quinolin-6-ylpyrazole-4-carboxylic acid Traditional Name: 5-propyl-1-(6-quinolyl)pyrazole-4-carboxylic acid Formula: C16H15N3O2 MolecularWeight: 281.3092

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC3=C(C=C2)N=CC=C3)C(=O)O

Isomeric SMILES

CCCC1=C(C=NN1C2=CC3=C(C=C2)N=CC=C3)C(=O)O

InChI

InChI=1S/C16H15N3O2/c1-2-4-15-13(16(20)21)10-18-19(15)12-6-7-14-11(9-12)5-3-8-17-14/h3,5-10H,2,4H2,1H3,(H,20,21)