1-[2-(hydroxymethyl)-1-methyl-6-oxidanyl-benzimidazol-5-yl]butan-1-one

Systemtic Name: 1-[2-(hydroxymethyl)-1-methyl-6-oxidanyl-benzimidazol-5-yl]butan-1-one Openeye Name: 1-[6-hydroxy-2-(hydroxymethyl)-1-methyl-benzimidazol-5-yl]butan-1-one CAS Name: 1-[6-hydroxy-2-(hydroxymethyl)-1-methyl-5-benzimidazolyl]-1-butanone IUPAC Name: 1-[6-hydroxy-2-(hydroxymethyl)-1-methylbenzimidazol-5-yl]butan-1-one Traditional Name: 1-(6-hydroxy-1-methyl-2-methylol-benzimidazol-5-yl)butan-1-one Formula: C13H16N2O3 MolecularWeight: 248.27774

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC2=C(C=C1O)N(C(=N2)CO)C

Isomeric SMILES

CCCC(=O)C1=CC2=C(C=C1O)N(C(=N2)CO)C

InChI

InChI=1S/C13H16N2O3/c1-3-4-11(17)8-5-9-10(6-12(8)18)15(2)13(7-16)14-9/h5-6,16,18H,3-4,7H2,1-2H3