3-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 3-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,3-benzoxazole-2-thione Openeye Name: 3-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,3-benzoxazole-2-thione CAS Name: 3-[[(2S,6S)-2,6-dimethyl-4-morpholin-4-iumyl]methyl]-1,3-benzoxazole-2-thione IUPAC Name: 3-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,3-benzoxazole-2-thione Traditional Name: 3-[[(2S,6S)-2,6-dimethylmorpholin-4-ium-4-yl]methyl]-1,3-benzoxazole-2-thione Formula: C14H19N2O2S+ MolecularWeight: 279.37786

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Descriptors Computed from Structure

Canonical SMILES:

CC1C[NH+](CC(O1)C)CN2C3=CC=CC=C3OC2=S

Isomeric SMILES

C[C@H]1C[NH+](C[C@@H](O1)C)CN2C3=CC=CC=C3OC2=S

InChI

InChI=1S/C14H18N2O2S/c1-10-7-15(8-11(2)17-10)9-16-12-5-3-4-6-13(12)18-14(16)19/h3-6,10-11H,7-9H2,1-2H3/p+1/t10-,11-/m0/s1