4-[3-[[4-(4-propan-2-ylphenoxy)phenyl]amino]propoxy]benzoic acid

Systemtic Name: 4-[3-[[4-(4-propan-2-ylphenoxy)phenyl]amino]propoxy]benzoic acid Openeye Name: 4-[3-[4-(4-isopropylphenoxy)anilino]propoxy]benzoic acid CAS Name: 4-[3-[4-(4-propan-2-ylphenoxy)anilino]propoxy]benzoic acid IUPAC Name: 4-[3-[4-(4-propan-2-ylphenoxy)anilino]propoxy]benzoic acid Traditional Name: 4-[3-[4-(4-isopropylphenoxy)anilino]propoxy]benzoic acid Formula: C25H27NO4 MolecularWeight: 405.48618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NCCCOC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NCCCOC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C25H27NO4/c1-18(2)19-4-12-23(13-5-19)30-24-14-8-21(9-15-24)26-16-3-17-29-22-10-6-20(7-11-22)25(27)28/h4-15,18,26H,3,16-17H2,1-2H3,(H,27,28)