3-phenyl-3-[4-[[4-(pyridin-2-ylamino)phenyl]carbonylamino]phenoxy]propanoic acid

Systemtic Name: 3-phenyl-3-[4-[[4-(pyridin-2-ylamino)phenyl]carbonylamino]phenoxy]propanoic acid Openeye Name: 3-phenyl-3-[4-[[4-(2-pyridylamino)benzoyl]amino]phenoxy]propanoic acid CAS Name: 3-[4-[[oxo-[4-(2-pyridinylamino)phenyl]methyl]amino]phenoxy]-3-phenylpropanoic acid IUPAC Name: 3-phenyl-3-[4-[[4-(pyridin-2-ylamino)benzoyl]amino]phenoxy]propanoic acid Traditional Name: 3-phenyl-3-[4-[[4-(2-pyridylamino)benzoyl]amino]phenoxy]propionic acid Formula: C27H23N3O4 MolecularWeight: 453.48922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)O)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)O)OC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)NC4=CC=CC=N4

InChI

InChI=1S/C27H23N3O4/c31-26(32)18-24(19-6-2-1-3-7-19)34-23-15-13-22(14-16-23)30-27(33)20-9-11-21(12-10-20)29-25-8-4-5-17-28-25/h1-17,24H,18H2,(H,28,29)(H,30,33)(H,31,32)