ethyl 2-(pyridin-1-ium-1-ylcarbamoylsulfanyl)ethanoate

Systemtic Name: ethyl 2-(pyridin-1-ium-1-ylcarbamoylsulfanyl)ethanoate Openeye Name: ethyl 2-(pyridin-1-ium-1-ylcarbamoylsulfanyl)acetate CAS Name: 2-[[oxo-(1-pyridin-1-iumylamino)methyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(pyridin-1-ium-1-ylcarbamoylsulfanyl)acetate Traditional Name: 2-(pyridin-1-ium-1-ylcarbamoylthio)acetic acid ethyl ester Formula: C10H13N2O3S+ MolecularWeight: 241.28682

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC(=O)N[N+]1=CC=CC=C1

Isomeric SMILES

CCOC(=O)CSC(=O)N[N+]1=CC=CC=C1

InChI

InChI=1S/C10H12N2O3S/c1-2-15-9(13)8-16-10(14)11-12-6-4-3-5-7-12/h3-7H,2,8H2,1H3/p+1