1-(7-chloranylquinolin-4-yl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-(7-chloranylquinolin-4-yl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid Openeye Name: 1-(7-chloro-4-quinolyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid CAS Name: 1-(7-chloro-4-quinolinyl)-5-[2-(cyclopropylmethoxy)-6-methoxyphenyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-(7-chloroquinolin-4-yl)-5-[2-(cyclopropylmethoxy)-6-methoxyphenyl]pyrazole-3-carboxylic acid Traditional Name: 1-(7-chloro-4-quinolyl)-5-[2-(cyclopropylmethoxy)-6-methoxy-phenyl]pyrazole-3-carboxylic acid Formula: C24H20ClN3O4 MolecularWeight: 449.8863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OCC2CC2)C3=CC(=NN3C4=C5C=CC(=CC5=NC=C4)Cl)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OCC2CC2)C3=CC(=NN3C4=C5C=CC(=CC5=NC=C4)Cl)C(=O)O

InChI

InChI=1S/C24H20ClN3O4/c1-31-21-3-2-4-22(32-13-14-5-6-14)23(21)20-12-18(24(29)30)27-28(20)19-9-10-26-17-11-15(25)7-8-16(17)19/h2-4,7-12,14H,5-6,13H2,1H3,(H,29,30)