[1-(1H-benzimidazol-2-ylsulfanyl)-1-carboxyoxy-butan-2-yl] hydrogen carbonate

Systemtic Name: [1-(1H-benzimidazol-2-ylsulfanyl)-1-carboxyoxy-butan-2-yl] hydrogen carbonate Openeye Name: [1-(1H-benzimidazol-2-ylsulfanyl)-2-carboxyoxy-butyl] hydrogen carbonate CAS Name: carbonic acid [1-(1H-benzimidazol-2-ylthio)-1-carboxyoxybutan-2-yl] ester IUPAC Name: [1-(1H-benzimidazol-2-ylsulfanyl)-1-carboxyoxybutan-2-yl] hydrogen carbonate Traditional Name: carbonic acid [1-(1H-benzimidazol-2-ylthio)-2-carboxyoxy-butyl] ester Formula: C13H14N2O6S MolecularWeight: 326.32506

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(OC(=O)O)SC1=NC2=CC=CC=C2N1)OC(=O)O

Isomeric SMILES

CCC(C(OC(=O)O)SC1=NC2=CC=CC=C2N1)OC(=O)O

InChI

InChI=1S/C13H14N2O6S/c1-2-9(20-12(16)17)10(21-13(18)19)22-11-14-7-5-3-4-6-8(7)15-11/h3-6,9-10H,2H2,1H3,(H,14,15)(H,16,17)(H,18,19)