[2-[(2,5-dimethylphenyl)disulfanyl]-2-oxidanyl-2-phosphono-ethyl]-trimethyl-azanium

Systemtic Name: [2-[(2,5-dimethylphenyl)disulfanyl]-2-oxidanyl-2-phosphono-ethyl]-trimethyl-azanium Openeye Name: [2-[(2,5-dimethylphenyl)disulfanyl]-2-hydroxy-2-phosphono-ethyl]-trimethyl-ammonium CAS Name: [2-[(2,5-dimethylphenyl)disulfanyl]-2-hydroxy-2-phosphonoethyl]-trimethylammonium IUPAC Name: [2-[(2,5-dimethylphenyl)disulfanyl]-2-hydroxy-2-phosphonoethyl]-trimethylazanium Traditional Name: [2-[(2,5-dimethylphenyl)disulfanyl]-2-hydroxy-2-phosphono-ethyl]-trimethyl-ammonium Formula: C13H23NO4PS2+ MolecularWeight: 352.429781

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SSC(C[N+](C)(C)C)(O)P(=O)(O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)SSC(C[N+](C)(C)C)(O)P(=O)(O)O

InChI

InChI=1S/C13H22NO4PS2/c1-10-6-7-11(2)12(8-10)20-21-13(15,19(16,17)18)9-14(3,4)5/h6-8,15H,9H2,1-5H3,(H-,16,17,18)/p+1