4-[(3,5-dimethoxyphenyl)methyl]thiomorpholin-4-ium

Systemtic Name: 4-[(3,5-dimethoxyphenyl)methyl]thiomorpholin-4-ium Openeye Name: 4-[(3,5-dimethoxyphenyl)methyl]thiomorpholin-4-ium CAS Name: 4-[(3,5-dimethoxyphenyl)methyl]thiomorpholin-4-ium IUPAC Name: 4-[(3,5-dimethoxyphenyl)methyl]thiomorpholin-4-ium Traditional Name: 4-(3,5-dimethoxybenzyl)thiomorpholin-4-ium Formula: C13H20NO2S+ MolecularWeight: 254.3684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19NO2S/c1-15-12-7-11(8-13(9-12)16-2)10-14-3-5-17-6-4-14/h7-9H,3-6,10H2,1-2H3/p+1