bis(2-hydroxyethyl)-[[3-methoxy-4-[(2R)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methyl]azanium

Systemtic Name: bis(2-hydroxyethyl)-[[3-methoxy-4-[(2R)-2-oxidanyl-3-thiomorpholin-4-ium-4-yl-propoxy]phenyl]methyl]azanium Openeye Name: bis(2-hydroxyethyl)-[[4-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]-3-methoxy-phenyl]methyl]ammonium CAS Name: bis(2-hydroxyethyl)-[[4-[(2R)-2-hydroxy-3-(4-thiomorpholin-4-iumyl)propoxy]-3-methoxyphenyl]methyl]ammonium IUPAC Name: bis(2-hydroxyethyl)-[[4-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-ylpropoxy]-3-methoxyphenyl]methyl]azanium Traditional Name: bis(2-hydroxyethyl)-[4-[(2R)-2-hydroxy-3-thiomorpholin-4-ium-4-yl-propoxy]-3-methoxy-benzyl]ammonium Formula: C19H34N2O5S+2 MolecularWeight: 402.54866

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+](CCO)CCO)OCC(C[NH+]2CCSCC2)O

Isomeric SMILES

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

InChI

InChI=1S/C19H32N2O5S/c1-25-19-12-16(13-20(4-8-22)5-9-23)2-3-18(19)26-15-17(24)14-21-6-10-27-11-7-21/h2-3,12,17,22-24H,4-11,13-15H2,1H3/p+2/t17-/m1/s1