2-[5-chloranyl-2-ethoxy-4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[5-chloranyl-2-ethoxy-4-[2-[[1-(4-hydroxyphenyl)-1-oxidanyl-propan-2-yl]amino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[5-chloro-2-ethoxy-4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]phenoxy]acetic acid CAS Name: 2-[5-chloro-2-ethoxy-4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[5-chloro-2-ethoxy-4-[2-[[1-hydroxy-1-(4-hydroxyphenyl)propan-2-yl]amino]ethyl]phenoxy]acetic acid Traditional Name: 2-[5-chloro-2-ethoxy-4-[2-[[2-hydroxy-2-(4-hydroxyphenyl)-1-methyl-ethyl]amino]ethyl]phenoxy]acetic acid Formula: C21H26ClNO6 MolecularWeight: 423.88724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CCNC(C)C(C2=CC=C(C=C2)O)O)Cl)OCC(=O)O

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CCNC(C)C(C2=CC=C(C=C2)O)O)Cl)OCC(=O)O

InChI

InChI=1S/C21H26ClNO6/c1-3-28-18-10-15(17(22)11-19(18)29-12-20(25)26)8-9-23-13(2)21(27)14-4-6-16(24)7-5-14/h4-7,10-11,13,21,23-24,27H,3,8-9,12H2,1-2H3,(H,25,26)