dimethyl-[[2-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)-5-phenyl-phenyl]methyl]azanium

Systemtic Name: dimethyl-[[2-(2-oxidanylidene-2-thiomorpholin-4-yl-ethoxy)-5-phenyl-phenyl]methyl]azanium Openeye Name: dimethyl-[[2-(2-oxo-2-thiomorpholino-ethoxy)-5-phenyl-phenyl]methyl]ammonium CAS Name: dimethyl-[[2-(2-oxo-2-thiomorpholin-4-ylethoxy)-5-phenylphenyl]methyl]ammonium IUPAC Name: dimethyl-[[2-(2-oxo-2-thiomorpholin-4-ylethoxy)-5-phenylphenyl]methyl]azanium Traditional Name: [2-(2-keto-2-thiomorpholino-ethoxy)-5-phenyl-benzyl]-dimethyl-ammonium Formula: C21H27N2O2S+ MolecularWeight: 371.51628

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=C(C=CC(=C1)C2=CC=CC=C2)OCC(=O)N3CCSCC3

Isomeric SMILES

C[NH+](C)CC1=C(C=CC(=C1)C2=CC=CC=C2)OCC(=O)N3CCSCC3

InChI

InChI=1S/C21H26N2O2S/c1-22(2)15-19-14-18(17-6-4-3-5-7-17)8-9-20(19)25-16-21(24)23-10-12-26-13-11-23/h3-9,14H,10-13,15-16H2,1-2H3/p+1