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2-(2,4-dimethylphenyl)sulfanylethyl-(2-hydroxyethyl)azanium

2-(2,4-dimethylphenyl)sulfanylethyl-(2-hydroxyethyl)azanium

Systemtic Name:2-(2,4-dimethylphenyl)sulfanylethyl-(2-hydroxyethyl)azanium
Openeye Name:2-(2,4-dimethylphenyl)sulfanylethyl-(2-hydroxyethyl)ammonium
CAS Name:2-[(2,4-dimethylphenyl)thio]ethyl-(2-hydroxyethyl)ammonium
IUPAC Name:2-(2,4-dimethylphenyl)sulfanylethyl-(2-hydroxyethyl)azanium
Traditional Name:2-[(2,4-dimethylphenyl)thio]ethyl-(2-hydroxyethyl)ammonium
Formula: C12H20NOS+
MolecularWeight: 226.3583
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC[NH2+]CCO)C


Isomeric SMILES

CC1=CC(=C(C=C1)SCC[NH2+]CCO)C


InChI

InChI=1S/C12H19NOS/c1-10-3-4-12(11(2)9-10)15-8-6-13-5-7-14/h3-4,9,13-14H,5-8H2,1-2H3/p+1


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