2-(hydroxymethyl)-1-(1H-imidazol-2-yl)butan-1-one

Systemtic Name: 2-(hydroxymethyl)-1-(1H-imidazol-2-yl)butan-1-one Openeye Name: 2-(hydroxymethyl)-1-(1H-imidazol-2-yl)butan-1-one CAS Name: 2-(hydroxymethyl)-1-(1H-imidazol-2-yl)-1-butanone IUPAC Name: 2-(hydroxymethyl)-1-(1H-imidazol-2-yl)butan-1-one Traditional Name: 1-(1H-imidazol-2-yl)-2-methylol-butan-1-one Formula: C8H12N2O2 MolecularWeight: 168.19308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)C(=O)C1=NC=CN1

Isomeric SMILES

CCC(CO)C(=O)C1=NC=CN1

InChI

InChI=1S/C8H12N2O2/c1-2-6(5-11)7(12)8-9-3-4-10-8/h3-4,6,11H,2,5H2,1H3,(H,9,10)