3-[4-(1-oxidanylpropyl)phenoxy]azepan-2-one

Systemtic Name: 3-[4-(1-oxidanylpropyl)phenoxy]azepan-2-one Openeye Name: 3-[4-(1-hydroxypropyl)phenoxy]azepan-2-one CAS Name: 3-[4-(1-hydroxypropyl)phenoxy]-2-azepanone IUPAC Name: 3-[4-(1-hydroxypropyl)phenoxy]azepan-2-one Traditional Name: 3-[4-(1-hydroxypropyl)phenoxy]azepan-2-one Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC2CCCCNC2=O)O

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC2CCCCNC2=O)O

InChI

InChI=1S/C15H21NO3/c1-2-13(17)11-6-8-12(9-7-11)19-14-5-3-4-10-16-15(14)18/h6-9,13-14,17H,2-5,10H2,1H3,(H,16,18)