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

Systemtic Name: 3-[4-(1-azanylethyl)phenoxy]azepan-2-one Openeye Name: 3-[4-(1-aminoethyl)phenoxy]azepan-2-one CAS Name: 3-[4-(1-aminoethyl)phenoxy]-2-azepanone IUPAC Name: 3-[4-(1-aminoethyl)phenoxy]azepan-2-one Traditional Name: 3-[4-(1-aminoethyl)phenoxy]azepan-2-one Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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