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

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-(3-methyl-4-propan-2-yl-phenoxy)ethoxy]benzoate Openeye Name: 3-chloro-5-ethoxy-4-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]benzoate CAS Name: 3-chloro-5-ethoxy-4-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]benzoate IUPAC Name: 3-chloro-5-ethoxy-4-[2-(3-methyl-4-propan-2-ylphenoxy)ethoxy]benzoate Traditional Name: 3-chloro-5-ethoxy-4-[2-(4-isopropyl-3-methyl-phenoxy)ethoxy]benzoate Formula: C21H24ClO5- MolecularWeight: 391.86526

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCCOC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OCCOC2=CC(=C(C=C2)C(C)C)C

InChI

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