2-(1H-imidazol-2-ylsulfonyl)octanoic acid

Systemtic Name: 2-(1H-imidazol-2-ylsulfonyl)octanoic acid Openeye Name: 2-(1H-imidazol-2-ylsulfonyl)octanoic acid CAS Name: 2-(1H-imidazol-2-ylsulfonyl)octanoic acid IUPAC Name: 2-(1H-imidazol-2-ylsulfonyl)octanoic acid Traditional Name: 2-(1H-imidazol-2-ylsulfonyl)caprylic acid Formula: C11H18N2O4S MolecularWeight: 274.33662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)S(=O)(=O)C1=NC=CN1

Isomeric SMILES

CCCCCCC(C(=O)O)S(=O)(=O)C1=NC=CN1

InChI

InChI=1S/C11H18N2O4S/c1-2-3-4-5-6-9(10(14)15)18(16,17)11-12-7-8-13-11/h7-9H,2-6H2,1H3,(H,12,13)(H,14,15)