2-[2-(carboxymethylsulfanyl)benzimidazol-1-yl]ethanoic acid

Systemtic Name: 2-[2-(carboxymethylsulfanyl)benzimidazol-1-yl]ethanoic acid Openeye Name: 2-[2-(carboxymethylsulfanyl)benzimidazol-1-yl]acetic acid CAS Name: 2-[2-(carboxymethylthio)-1-benzimidazolyl]acetic acid IUPAC Name: 2-[2-(carboxymethylsulfanyl)benzimidazol-1-yl]acetic acid Traditional Name: 2-[2-(carboxymethylthio)benzimidazol-1-yl]acetic acid Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(N2CC(=O)O)SCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=C(N2CC(=O)O)SCC(=O)O

InChI

InChI=1S/C11H10N2O4S/c14-9(15)5-13-8-4-2-1-3-7(8)12-11(13)18-6-10(16)17/h1-4H,5-6H2,(H,14,15)(H,16,17)