2-[3-ethoxy-1-[[4-[(5-phenylpyridin-3-yl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid

Systemtic Name: 2-[3-ethoxy-1-[[4-[(5-phenylpyridin-3-yl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid Openeye Name: 2-[3-ethoxy-1-[[4-[(5-phenyl-3-pyridyl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid CAS Name: 2-[3-ethoxy-1-[[4-[(5-phenyl-3-pyridinyl)methoxy]phenyl]methyl]-4-pyrazolyl]propanoic acid IUPAC Name: 2-[3-ethoxy-1-[[4-[(5-phenylpyridin-3-yl)methoxy]phenyl]methyl]pyrazol-4-yl]propanoic acid Traditional Name: 2-[3-ethoxy-1-[4-[(5-phenyl-3-pyridyl)methoxy]benzyl]pyrazol-4-yl]propionic acid Formula: C27H27N3O4 MolecularWeight: 457.52098

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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)C4=CC=CC=C4

Isomeric SMILES

CCOC1=NN(C=C1C(C)C(=O)O)CC2=CC=C(C=C2)OCC3=CN=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O4/c1-3-33-26-25(19(2)27(31)32)17-30(29-26)16-20-9-11-24(12-10-20)34-18-21-13-23(15-28-14-21)22-7-5-4-6-8-22/h4-15,17,19H,3,16,18H2,1-2H3,(H,31,32)