3-[4-(methylaminomethyl)phenoxy]azepan-2-one

Systemtic Name: 3-[4-(methylaminomethyl)phenoxy]azepan-2-one Openeye Name: 3-[4-(methylaminomethyl)phenoxy]azepan-2-one CAS Name: 3-[4-(methylaminomethyl)phenoxy]-2-azepanone IUPAC Name: 3-[4-(methylaminomethyl)phenoxy]azepan-2-one Traditional Name: 3-[4-(methylaminomethyl)phenoxy]azepan-2-one Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)OC2CCCCNC2=O

Isomeric SMILES

CNCC1=CC=C(C=C1)OC2CCCCNC2=O

InChI

InChI=1S/C14H20N2O2/c1-15-10-11-5-7-12(8-6-11)18-13-4-2-3-9-16-14(13)17/h5-8,13,15H,2-4,9-10H2,1H3,(H,16,17)