2-[4-[4-[3-(oxan-4-yloxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[4-[4-[3-(oxan-4-yloxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]ethanoic acid Openeye Name: 2-[4-[4-(3-tetrahydropyran-4-yloxy-1H-pyrazol-5-yl)phenyl]cyclohexyl]acetic acid CAS Name: 2-[4-[4-[3-(4-oxanyloxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid IUPAC Name: 2-[4-[4-[3-(oxan-4-yloxy)-1H-pyrazol-5-yl]phenyl]cyclohexyl]acetic acid Traditional Name: 2-[4-[4-(3-tetrahydropyran-4-yloxy-1H-pyrazol-5-yl)phenyl]cyclohexyl]acetic acid Formula: C22H28N2O4 MolecularWeight: 384.46872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CC(=O)O)C2=CC=C(C=C2)C3=CC(=NN3)OC4CCOCC4

Isomeric SMILES

C1CC(CCC1CC(=O)O)C2=CC=C(C=C2)C3=CC(=NN3)OC4CCOCC4

InChI

InChI=1S/C22H28N2O4/c25-22(26)13-15-1-3-16(4-2-15)17-5-7-18(8-6-17)20-14-21(24-23-20)28-19-9-11-27-12-10-19/h5-8,14-16,19H,1-4,9-13H2,(H,23,24)(H,25,26)