1-[2-(2-methoxyethylsulfonyl)ethyl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-[2-(2-methoxyethylsulfonyl)ethyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-[2-(2-methoxyethylsulfonyl)ethyl]triazole-4-carboxylic acid CAS Name: 1-[2-(2-methoxyethylsulfonyl)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-[2-(2-methoxyethylsulfonyl)ethyl]triazole-4-carboxylic acid Traditional Name: 1-[2-(2-methoxyethylsulfonyl)ethyl]triazole-4-carboxylic acid Formula: C8H13N3O5S MolecularWeight: 263.27092

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Descriptors Computed from Structure

Canonical SMILES:

COCCS(=O)(=O)CCN1C=C(N=N1)C(=O)O

Isomeric SMILES

COCCS(=O)(=O)CCN1C=C(N=N1)C(=O)O

InChI

InChI=1S/C8H13N3O5S/c1-16-3-5-17(14,15)4-2-11-6-7(8(12)13)9-10-11/h6H,2-5H2,1H3,(H,12,13)