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

Systemtic Name: 2-[3-phenyl-1-[[3-(pyridin-2-ylmethylcarbamoyl)phenyl]methyl]pyrazol-4-yl]propanoic acid Openeye Name: 2-[3-phenyl-1-[[3-(2-pyridylmethylcarbamoyl)phenyl]methyl]pyrazol-4-yl]propanoic acid CAS Name: 2-[1-[[3-[oxo-(2-pyridinylmethylamino)methyl]phenyl]methyl]-3-phenyl-4-pyrazolyl]propanoic acid IUPAC Name: 2-[3-phenyl-1-[[3-(pyridin-2-ylmethylcarbamoyl)phenyl]methyl]pyrazol-4-yl]propanoic acid Traditional Name: 2-[3-phenyl-1-[3-(2-pyridylmethylcarbamoyl)benzyl]pyrazol-4-yl]propionic acid Formula: C26H24N4O3 MolecularWeight: 440.49376

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC(=C3)C(=O)NCC4=CC=CC=N4)C(=O)O

Isomeric SMILES

CC(C1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC(=C3)C(=O)NCC4=CC=CC=N4)C(=O)O

InChI

InChI=1S/C26H24N4O3/c1-18(26(32)33)23-17-30(29-24(23)20-9-3-2-4-10-20)16-19-8-7-11-21(14-19)25(31)28-15-22-12-5-6-13-27-22/h2-14,17-18H,15-16H2,1H3,(H,28,31)(H,32,33)