4-(4-hydroxyphenyl)-1-methyl-2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxylic acid

Systemtic Name: 4-(4-hydroxyphenyl)-1-methyl-2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxylic acid Openeye Name: 4-(4-hydroxyphenyl)-1-methyl-2-[[4-(2-morpholinoethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxylic acid CAS Name: 4-(4-hydroxyphenyl)-1-methyl-2-[[4-[2-(4-morpholinyl)ethoxy]phenyl]methyl]-1-cyclohex-3-enecarboxylic acid IUPAC Name: 4-(4-hydroxyphenyl)-1-methyl-2-[[4-(2-morpholin-4-ylethoxy)phenyl]methyl]cyclohex-3-ene-1-carboxylic acid Traditional Name: 4-(4-hydroxyphenyl)-1-methyl-2-[4-(2-morpholinoethoxy)benzyl]cyclohex-3-ene-1-carboxylic acid Formula: C27H33NO5 MolecularWeight: 451.55462

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=CC1CC2=CC=C(C=C2)OCCN3CCOCC3)C4=CC=C(C=C4)O)C(=O)O

Isomeric SMILES

CC1(CCC(=CC1CC2=CC=C(C=C2)OCCN3CCOCC3)C4=CC=C(C=C4)O)C(=O)O

InChI

InChI=1S/C27H33NO5/c1-27(26(30)31)11-10-22(21-4-6-24(29)7-5-21)19-23(27)18-20-2-8-25(9-3-20)33-17-14-28-12-15-32-16-13-28/h2-9,19,23,29H,10-18H2,1H3,(H,30,31)