(2R)-2-azanyl-3-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanoate

Systemtic Name: (2R)-2-azanyl-3-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-propanoate Openeye Name: (2R)-2-amino-3-(1-oxidopyridin-1-ium-2-yl)sulfanyl-propanoate CAS Name: (2R)-2-amino-3-[(1-oxido-2-pyridin-1-iumyl)thio]propanoate IUPAC Name: (2R)-2-amino-3-(1-oxidopyridin-1-ium-2-yl)sulfanylpropanoate Traditional Name: (2R)-2-amino-3-[(1-oxidopyridin-1-ium-2-yl)thio]propionate Formula: C8H9N2O3S- MolecularWeight: 213.23366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(C(=O)[O-])N)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SC[C@@H](C(=O)[O-])N)[O-]

InChI

InChI=1S/C8H10N2O3S/c9-6(8(11)12)5-14-7-3-1-2-4-10(7)13/h1-4,6H,5,9H2,(H,11,12)/p-1/t6-/m0/s1