2-[3-ethoxy-1-[[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid

Systemtic Name: 2-[3-ethoxy-1-[[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid Openeye Name: 2-[3-ethoxy-1-[[3-methoxy-4-(3-pyridylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid CAS Name: 2-[3-ethoxy-1-[[3-methoxy-4-(3-pyridinylmethoxy)phenyl]methyl]-4-pyrazolyl]propanoic acid IUPAC Name: 2-[3-ethoxy-1-[[3-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methyl]pyrazol-4-yl]propanoic acid Traditional Name: 2-[3-ethoxy-1-[3-methoxy-4-(3-pyridylmethoxy)benzyl]pyrazol-4-yl]propionic acid Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C=C1C(C)C(=O)O)CC2=CC(=C(C=C2)OCC3=CN=CC=C3)OC

Isomeric SMILES

CCOC1=NN(C=C1C(C)C(=O)O)CC2=CC(=C(C=C2)OCC3=CN=CC=C3)OC

InChI

InChI=1S/C22H25N3O5/c1-4-29-21-18(15(2)22(26)27)13-25(24-21)12-16-7-8-19(20(10-16)28-3)30-14-17-6-5-9-23-11-17/h5-11,13,15H,4,12,14H2,1-3H3,(H,26,27)