2-(cyanomethylsulfinyl)ethanoic acid

Systemtic Name: 2-(cyanomethylsulfinyl)ethanoic acid Openeye Name: 2-(cyanomethylsulfinyl)acetic acid CAS Name: 2-(cyanomethylsulfinyl)acetic acid IUPAC Name: 2-(cyanomethylsulfinyl)acetic acid Traditional Name: 2-(cyanomethylsulfinyl)acetic acid Formula: C4H5NO3S MolecularWeight: 147.1524

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Descriptors Computed from Structure

Canonical SMILES:

C(C#N)S(=O)CC(=O)O

Isomeric SMILES

C(C#N)S(=O)CC(=O)O

InChI

InChI=1S/C4H5NO3S/c5-1-2-9(8)3-4(6)7/h2-3H2,(H,6,7)