2-chloranylethanoic acid; 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanoic acid

Systemtic Name: 2-chloranylethanoic acid; 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)ethanoic acid Openeye Name: 2-chloroacetic acid; 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetic acid CAS Name: 2-chloroacetic acid; 2-(4,5-dihydro-1H-imidazol-2-ylthio)acetic acid IUPAC Name: 2-chloroacetic acid; 2-(4,5-dihydro-1H-imidazol-2-ylsulfanyl)acetic acid Traditional Name: 2-chloroacetic acid; 2-(2-imidazolin-2-ylthio)acetic acid Formula: C7H11ClN2O4S MolecularWeight: 254.69124

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(N1)SCC(=O)O.C(C(=O)O)Cl

Isomeric SMILES

C1CN=C(N1)SCC(=O)O.C(C(=O)O)Cl

InChI

InChI=1S/C5H8N2O2S.C2H3ClO2/c8-4(9)3-10-5-6-1-2-7-5;3-1-2(4)5/h1-3H2,(H,6,7)(H,8,9);1H2,(H,4,5)