(2S)-2-[(3-methoxyphenyl)methyl]-4-(thian-4-yl)morpholin-4-ium

Systemtic Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(thian-4-yl)morpholin-4-ium Openeye Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-tetrahydrothiopyran-4-yl-morpholin-4-ium CAS Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(4-thianyl)morpholin-4-ium IUPAC Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(thian-4-yl)morpholin-4-ium Traditional Name: (2S)-2-m-anisyl-4-tetrahydrothiopyran-4-yl-morpholin-4-ium Formula: C17H26NO2S+ MolecularWeight: 308.45884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2C[NH+](CCO2)C3CCSCC3

Isomeric SMILES

COC1=CC=CC(=C1)C[C@H]2C[NH+](CCO2)C3CCSCC3

InChI

InChI=1S/C17H25NO2S/c1-19-16-4-2-3-14(11-16)12-17-13-18(7-8-20-17)15-5-9-21-10-6-15/h2-4,11,15,17H,5-10,12-13H2,1H3/p+1/t17-/m0/s1