cyclohexyl-[(2R)-3-[2-methoxy-4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[(2R)-3-[2-methoxy-4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]-2-oxidanyl-propyl]-methyl-azanium Openeye Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(4-thiomorpholin-4-iumylmethyl)phenoxy]propyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-2-hydroxy-3-[2-methoxy-4-(thiomorpholin-4-ium-4-ylmethyl)phenoxy]propyl]-methyl-ammonium Formula: C22H38N2O3S+2 MolecularWeight: 410.61372

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(COC1=C(C=C(C=C1)C[NH+]2CCSCC2)OC)O)C3CCCCC3

Isomeric SMILES

C[NH+](C[C@H](COC1=C(C=C(C=C1)C[NH+]2CCSCC2)OC)O)C3CCCCC3

InChI

InChI=1S/C22H36N2O3S/c1-23(19-6-4-3-5-7-19)16-20(25)17-27-21-9-8-18(14-22(21)26-2)15-24-10-12-28-13-11-24/h8-9,14,19-20,25H,3-7,10-13,15-17H2,1-2H3/p+2/t20-/m1/s1