3-[2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenyl]propanoic acid

Systemtic Name: 3-[2-[[4-(4-phenylbutoxy)phenyl]carbonylamino]phenyl]propanoic acid Openeye Name: 3-[2-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propanoic acid CAS Name: 3-[2-[[oxo-[4-(4-phenylbutoxy)phenyl]methyl]amino]phenyl]propanoic acid IUPAC Name: 3-[2-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propanoic acid Traditional Name: 3-[2-[[4-(4-phenylbutoxy)benzoyl]amino]phenyl]propionic acid Formula: C26H27NO4 MolecularWeight: 417.49688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3CCC(=O)O

InChI

InChI=1S/C26H27NO4/c28-25(29)18-15-21-11-4-5-12-24(21)27-26(30)22-13-16-23(17-14-22)31-19-7-6-10-20-8-2-1-3-9-20/h1-5,8-9,11-14,16-17H,6-7,10,15,18-19H2,(H,27,30)(H,28,29)