1-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]butan-1-one

Systemtic Name: 1-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]butan-1-one Openeye Name: 1-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]butan-1-one CAS Name: 1-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]-1-butanone IUPAC Name: 1-[2-(hydroxymethyl)-3H-benzimidazol-5-yl]butan-1-one Traditional Name: 1-(2-methylol-3H-benzimidazol-5-yl)butan-1-one Formula: C12H14N2O2 MolecularWeight: 218.25176

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1)N=C(N2)CO

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1)N=C(N2)CO

InChI

InChI=1S/C12H14N2O2/c1-2-3-11(16)8-4-5-9-10(6-8)14-12(7-15)13-9/h4-6,15H,2-3,7H2,1H3,(H,13,14)