2-chloranyl-5-[3-[4-(4-phenylbutoxy)phenyl]propanoylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[3-[4-(4-phenylbutoxy)phenyl]propanoylamino]benzoic acid Openeye Name: 2-chloro-5-[3-[4-(4-phenylbutoxy)phenyl]propanoylamino]benzoic acid CAS Name: 2-chloro-5-[[1-oxo-3-[4-(4-phenylbutoxy)phenyl]propyl]amino]benzoic acid IUPAC Name: 2-chloro-5-[3-[4-(4-phenylbutoxy)phenyl]propanoylamino]benzoic acid Traditional Name: 2-chloro-5-[3-[4-(4-phenylbutoxy)phenyl]propanoylamino]benzoic acid Formula: C26H26ClNO4 MolecularWeight: 451.94194

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)CCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CC=C(C=C2)CCC(=O)NC3=CC(=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C26H26ClNO4/c27-24-15-12-21(18-23(24)26(30)31)28-25(29)16-11-20-9-13-22(14-10-20)32-17-5-4-8-19-6-2-1-3-7-19/h1-3,6-7,9-10,12-15,18H,4-5,8,11,16-17H2,(H,28,29)(H,30,31)