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

Systemtic Name: 2-[4-(2-azanylethyl)phenoxy]-1-(azepan-1-yl)propan-1-one Openeye Name: 2-[4-(2-aminoethyl)phenoxy]-1-(azepan-1-yl)propan-1-one CAS Name: 2-[4-(2-aminoethyl)phenoxy]-1-(1-azepanyl)-1-propanone IUPAC Name: 2-[4-(2-aminoethyl)phenoxy]-1-(azepan-1-yl)propan-1-one Traditional Name: 2-[4-(2-aminoethyl)phenoxy]-1-(azepan-1-yl)propan-1-one Formula: C17H26N2O2 MolecularWeight: 290.40054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCCCC1)OC2=CC=C(C=C2)CCN

Isomeric SMILES

CC(C(=O)N1CCCCCC1)OC2=CC=C(C=C2)CCN

InChI

InChI=1S/C17H26N2O2/c1-14(17(20)19-12-4-2-3-5-13-19)21-16-8-6-15(7-9-16)10-11-18/h6-9,14H,2-5,10-13,18H2,1H3