2-[[3,5-bis(chloranyl)phenyl]methyl]-4-oxidanyl-morpholin-4-ium-4-carbodithioic acid

Systemtic Name: 2-[[3,5-bis(chloranyl)phenyl]methyl]-4-oxidanyl-morpholin-4-ium-4-carbodithioic acid Openeye Name: 2-[(3,5-dichlorophenyl)methyl]-4-hydroxy-morpholin-4-ium-4-carbodithioic acid CAS Name: 2-[(3,5-dichlorophenyl)methyl]-4-hydroxy-4-morpholin-4-iumcarbodithioic acid IUPAC Name: 2-[(3,5-dichlorophenyl)methyl]-4-hydroxymorpholin-4-ium-4-carbodithioic acid Traditional Name: 2-(3,5-dichlorobenzyl)-4-hydroxy-morpholin-4-ium-4-carbodithioic acid Formula: C12H14Cl2NO2S2+ MolecularWeight: 339.28106

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(C[N+]1(C(=S)S)O)CC2=CC(=CC(=C2)Cl)Cl

Isomeric SMILES

C1COC(C[N+]1(C(=S)S)O)CC2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H13Cl2NO2S2/c13-9-3-8(4-10(14)6-9)5-11-7-15(16,12(18)19)1-2-17-11/h3-4,6,11,16H,1-2,5,7H2/p+1