diethyl-[2-[[2-[(2R)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methylamino]ethyl]azanium

Systemtic Name: diethyl-[2-[[2-[(2R)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methylamino]ethyl]azanium Openeye Name: diethyl-[2-[[2-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methylamino]ethyl]ammonium CAS Name: diethyl-[2-[[2-[(2R)-2-hydroxy-3-(4-thiomorpholin-4-iumyl)propoxy]phenyl]methylamino]ethyl]ammonium IUPAC Name: diethyl-[2-[[2-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-ylpropoxy]phenyl]methylamino]ethyl]azanium Traditional Name: diethyl-[2-[[2-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]benzyl]amino]ethyl]ammonium Formula: C20H37N3O2S+2 MolecularWeight: 383.59168

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNCC1=CC=CC=C1OCC(C[NH+]2CCSCC2)O

Isomeric SMILES

CC[NH+](CC)CCNCC1=CC=CC=C1OC[C@@H](C[NH+]2CCSCC2)O

InChI

InChI=1S/C20H35N3O2S/c1-3-22(4-2)10-9-21-15-18-7-5-6-8-20(18)25-17-19(24)16-23-11-13-26-14-12-23/h5-8,19,21,24H,3-4,9-17H2,1-2H3/p+2/t19-/m1/s1