2-[[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]propanoic acid

Systemtic Name: 2-[[3,5-dimethyl-4-(4-oxidanyl-3-propan-2-yl-phenoxy)phenyl]amino]propanoic acid Openeye Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]propanoic acid CAS Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]propanoic acid IUPAC Name: 2-[4-(4-hydroxy-3-propan-2-ylphenoxy)-3,5-dimethylanilino]propanoic acid Traditional Name: 2-[4-(4-hydroxy-3-isopropyl-phenoxy)-3,5-dimethyl-anilino]propionic acid Formula: C20H25NO4 MolecularWeight: 343.4168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)NC(C)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OC2=CC(=C(C=C2)O)C(C)C)C)NC(C)C(=O)O

InChI

InChI=1S/C20H25NO4/c1-11(2)17-10-16(6-7-18(17)22)25-19-12(3)8-15(9-13(19)4)21-14(5)20(23)24/h6-11,14,21-22H,1-5H3,(H,23,24)