2-[4-[6-(5-methyl-1H-pyrazol-4-yl)quinolin-4-yl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[6-(5-methyl-1H-pyrazol-4-yl)quinolin-4-yl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[6-(5-methyl-1H-pyrazol-4-yl)-4-quinolyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[6-(5-methyl-1H-pyrazol-4-yl)-4-quinolinyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[6-(5-methyl-1H-pyrazol-4-yl)quinolin-4-yl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[6-(5-methyl-1H-pyrazol-4-yl)-4-quinolyl]piperazino]acetic acid Formula: C19H21N5O2 MolecularWeight: 351.40234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C2=CC3=C(C=CN=C3C=C2)N4CCN(CC4)CC(=O)O

Isomeric SMILES

CC1=C(C=NN1)C2=CC3=C(C=CN=C3C=C2)N4CCN(CC4)CC(=O)O

InChI

InChI=1S/C19H21N5O2/c1-13-16(11-21-22-13)14-2-3-17-15(10-14)18(4-5-20-17)24-8-6-23(7-9-24)12-19(25)26/h2-5,10-11H,6-9,12H2,1H3,(H,21,22)(H,25,26)