4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium

Systemtic Name: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium Openeye Name: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium CAS Name: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium IUPAC Name: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium Traditional Name: 4-[4-(2,6-dimethoxyphenoxy)butyl]thiomorpholin-4-ium Formula: C16H26NO3S+ MolecularWeight: 312.44754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25NO3S/c1-18-14-6-5-7-15(19-2)16(14)20-11-4-3-8-17-9-12-21-13-10-17/h5-7H,3-4,8-13H2,1-2H3/p+1