2-(hydroxymethyl)-8-imidazol-1-yl-octanoic acid

Systemtic Name: 2-(hydroxymethyl)-8-imidazol-1-yl-octanoic acid Openeye Name: 2-(hydroxymethyl)-8-imidazol-1-yl-octanoic acid CAS Name: 2-(hydroxymethyl)-8-(1-imidazolyl)octanoic acid IUPAC Name: 2-(hydroxymethyl)-8-imidazol-1-yloctanoic acid Traditional Name: 8-imidazol-1-yl-2-methylol-caprylic acid Formula: C12H20N2O3 MolecularWeight: 240.2988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)CCCCCCC(CO)C(=O)O

Isomeric SMILES

C1=CN(C=N1)CCCCCCC(CO)C(=O)O

InChI

InChI=1S/C12H20N2O3/c15-9-11(12(16)17)5-3-1-2-4-7-14-8-6-13-10-14/h6,8,10-11,15H,1-5,7,9H2,(H,16,17)