3-[2-(3-cyclohexylpropoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid

Systemtic Name: 3-[2-(3-cyclohexylpropoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Openeye Name: 3-[2-(3-cyclohexylpropoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid CAS Name: 3-[2-(3-cyclohexylpropoxy)-4-(1-pyrazolylmethyl)phenyl]propanoic acid IUPAC Name: 3-[2-(3-cyclohexylpropoxy)-4-(pyrazol-1-ylmethyl)phenyl]propanoic acid Traditional Name: 3-[2-(3-cyclohexylpropoxy)-4-(pyrazol-1-ylmethyl)phenyl]propionic acid Formula: C22H30N2O3 MolecularWeight: 370.4852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCCOC2=C(C=CC(=C2)CN3C=CC=N3)CCC(=O)O

Isomeric SMILES

C1CCC(CC1)CCCOC2=C(C=CC(=C2)CN3C=CC=N3)CCC(=O)O

InChI

InChI=1S/C22H30N2O3/c25-22(26)12-11-20-10-9-19(17-24-14-5-13-23-24)16-21(20)27-15-4-8-18-6-2-1-3-7-18/h5,9-10,13-14,16,18H,1-4,6-8,11-12,15,17H2,(H,25,26)