4-[(2,5-dimethylphenyl)sulfanylmethyl]morpholin-4-ium

Systemtic Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]morpholin-4-ium Openeye Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]morpholin-4-ium CAS Name: 4-[[(2,5-dimethylphenyl)thio]methyl]morpholin-4-ium IUPAC Name: 4-[(2,5-dimethylphenyl)sulfanylmethyl]morpholin-4-ium Traditional Name: 4-[[(2,5-dimethylphenyl)thio]methyl]morpholin-4-ium Formula: C13H20NOS+ MolecularWeight: 238.369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC[NH+]2CCOCC2

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC[NH+]2CCOCC2

InChI

InChI=1S/C13H19NOS/c1-11-3-4-12(2)13(9-11)16-10-14-5-7-15-8-6-14/h3-4,9H,5-8,10H2,1-2H3/p+1