cyclohexyl-methyl-[(2R)-3-(4-morpholin-4-ylsulfonylphenoxy)-2-oxidanyl-propyl]azanium

Systemtic Name: cyclohexyl-methyl-[(2R)-3-(4-morpholin-4-ylsulfonylphenoxy)-2-oxidanyl-propyl]azanium Openeye Name: cyclohexyl-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]-methyl-ammonium CAS Name: cyclohexyl-[(2R)-2-hydroxy-3-[4-(4-morpholinylsulfonyl)phenoxy]propyl]-methylammonium IUPAC Name: cyclohexyl-[(2R)-2-hydroxy-3-(4-morpholin-4-ylsulfonylphenoxy)propyl]-methylazanium Traditional Name: cyclohexyl-[(2R)-2-hydroxy-3-(4-morpholinosulfonylphenoxy)propyl]-methyl-ammonium Formula: C20H33N2O5S+ MolecularWeight: 413.55142

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(COC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)O)C3CCCCC3

Isomeric SMILES

C[NH+](C[C@H](COC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2)O)C3CCCCC3

InChI

InChI=1S/C20H32N2O5S/c1-21(17-5-3-2-4-6-17)15-18(23)16-27-19-7-9-20(10-8-19)28(24,25)22-11-13-26-14-12-22/h7-10,17-18,23H,2-6,11-16H2,1H3/p+1/t18-/m1/s1