3-chloranyl-5-ethoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzoic acid

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-(5-methyl-2-propan-2-yl-phenoxy)ethoxy]benzoic acid Openeye Name: 3-chloro-5-ethoxy-4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]benzoic acid CAS Name: 3-chloro-5-ethoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzoic acid IUPAC Name: 3-chloro-5-ethoxy-4-[2-(5-methyl-2-propan-2-ylphenoxy)ethoxy]benzoic acid Traditional Name: 3-chloro-5-ethoxy-4-[2-(2-isopropyl-5-methyl-phenoxy)ethoxy]benzoic acid Formula: C21H25ClO5 MolecularWeight: 392.8732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)O)Cl)OCCOC2=C(C=CC(=C2)C)C(C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)O)Cl)OCCOC2=C(C=CC(=C2)C)C(C)C

InChI

InChI=1S/C21H25ClO5/c1-5-25-19-12-15(21(23)24)11-17(22)20(19)27-9-8-26-18-10-14(4)6-7-16(18)13(2)3/h6-7,10-13H,5,8-9H2,1-4H3,(H,23,24)