3-[2-ethoxy-4-(hydroxymethyl)phenoxy]azepan-2-one

Systemtic Name: 3-[2-ethoxy-4-(hydroxymethyl)phenoxy]azepan-2-one Openeye Name: 3-[2-ethoxy-4-(hydroxymethyl)phenoxy]azepan-2-one CAS Name: 3-[2-ethoxy-4-(hydroxymethyl)phenoxy]-2-azepanone IUPAC Name: 3-[2-ethoxy-4-(hydroxymethyl)phenoxy]azepan-2-one Traditional Name: 3-(2-ethoxy-4-methylol-phenoxy)azepan-2-one Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CO)OC2CCCCNC2=O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CO)OC2CCCCNC2=O

InChI

InChI=1S/C15H21NO4/c1-2-19-14-9-11(10-17)6-7-12(14)20-13-5-3-4-8-16-15(13)18/h6-7,9,13,17H,2-5,8,10H2,1H3,(H,16,18)