2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[[4-(2-morpholin-2-ylethoxy)phenyl]methyl]hex-4-enoic acid

Systemtic Name: 2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[[4-(2-morpholin-2-ylethoxy)phenyl]methyl]hex-4-enoic acid Openeye Name: 2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[[4-(2-morpholin-2-ylethoxy)phenyl]methyl]hex-4-enoic acid CAS Name: 2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[[4-[2-(2-morpholinyl)ethoxy]phenyl]methyl]-4-hexenoic acid IUPAC Name: 2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[[4-(2-morpholin-2-ylethoxy)phenyl]methyl]hex-4-enoic acid Traditional Name: 2-(4-methoxyphenyl)sulfonyl-5-methyl-2-[4-(2-morpholin-2-ylethoxy)benzyl]hex-4-enoic acid Formula: C27H35NO7S MolecularWeight: 517.6343

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC(CC1=CC=C(C=C1)OCCC2CNCCO2)(C(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC(=CCC(CC1=CC=C(C=C1)OCCC2CNCCO2)(C(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C27H35NO7S/c1-20(2)12-14-27(26(29)30,36(31,32)25-10-8-22(33-3)9-11-25)18-21-4-6-23(7-5-21)34-16-13-24-19-28-15-17-35-24/h4-12,24,28H,13-19H2,1-3H3,(H,29,30)