3-[2-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-5-chloranyl-phenyl]propanoate

Systemtic Name: 3-[2-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-5-chloranyl-phenyl]propanoate Openeye Name: 3-[2-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-5-chloro-phenyl]propanoate CAS Name: 3-[2-[2-(2-tert-butyl-4-methylphenoxy)ethoxy]-5-chlorophenyl]propanoate IUPAC Name: 3-[2-[2-(2-tert-butyl-4-methylphenoxy)ethoxy]-5-chlorophenyl]propanoate Traditional Name: 3-[2-[2-(2-tert-butyl-4-methyl-phenoxy)ethoxy]-5-chloro-phenyl]propionate Formula: C22H26ClO4- MolecularWeight: 389.89244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)CCC(=O)[O-])C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OCCOC2=C(C=C(C=C2)Cl)CCC(=O)[O-])C(C)(C)C

InChI

InChI=1S/C22H27ClO4/c1-15-5-8-20(18(13-15)22(2,3)4)27-12-11-26-19-9-7-17(23)14-16(19)6-10-21(24)25/h5,7-9,13-14H,6,10-12H2,1-4H3,(H,24,25)/p-1