3-(hydroxymethyl)-1-(phenylmethyl)azepan-2-one

Systemtic Name: 3-(hydroxymethyl)-1-(phenylmethyl)azepan-2-one Openeye Name: 1-benzyl-3-(hydroxymethyl)azepan-2-one CAS Name: 3-(hydroxymethyl)-1-(phenylmethyl)-2-azepanone IUPAC Name: 1-benzyl-3-(hydroxymethyl)azepan-2-one Traditional Name: 1-benzyl-3-methylol-azepan-2-one Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C(C1)CO)CC2=CC=CC=C2

Isomeric SMILES

C1CCN(C(=O)C(C1)CO)CC2=CC=CC=C2

InChI

InChI=1S/C14H19NO2/c16-11-13-8-4-5-9-15(14(13)17)10-12-6-2-1-3-7-12/h1-3,6-7,13,16H,4-5,8-11H2