3-[3-(1-azanylethyl)phenoxy]azepan-2-one

Systemtic Name: 3-[3-(1-azanylethyl)phenoxy]azepan-2-one Openeye Name: 3-[3-(1-aminoethyl)phenoxy]azepan-2-one CAS Name: 3-[3-(1-aminoethyl)phenoxy]-2-azepanone IUPAC Name: 3-[3-(1-aminoethyl)phenoxy]azepan-2-one Traditional Name: 3-[3-(1-aminoethyl)phenoxy]azepan-2-one Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)OC2CCCCNC2=O)N

Isomeric SMILES

CC(C1=CC(=CC=C1)OC2CCCCNC2=O)N

InChI

InChI=1S/C14H20N2O2/c1-10(15)11-5-4-6-12(9-11)18-13-7-2-3-8-16-14(13)17/h4-6,9-10,13H,2-3,7-8,15H2,1H3,(H,16,17)