[4-[2,3-bis(sulfanyl)propoxycarbonyl]phenyl]-trimethyl-azanium

Systemtic Name: [4-[2,3-bis(sulfanyl)propoxycarbonyl]phenyl]-trimethyl-azanium Openeye Name: [4-[2,3-bis(sulfanyl)propoxycarbonyl]phenyl]-trimethyl-ammonium CAS Name: [4-[2,3-dimercaptopropoxy(oxo)methyl]phenyl]-trimethylammonium IUPAC Name: [4-[2,3-bis(sulfanyl)propoxycarbonyl]phenyl]-trimethylazanium Traditional Name: [4-(2,3-dimercaptopropoxycarbonyl)phenyl]-trimethyl-ammonium Formula: C13H20NO2S2+ MolecularWeight: 286.4334

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)C(=O)OCC(CS)S

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)C(=O)OCC(CS)S

InChI

InChI=1S/C13H19NO2S2/c1-14(2,3)11-6-4-10(5-7-11)13(15)16-8-12(18)9-17/h4-7,12H,8-9H2,1-3H3,(H-,17,18)/p+1