3-[1-(4-propylphenyl)ethylamino]azepan-2-one

Systemtic Name: 3-[1-(4-propylphenyl)ethylamino]azepan-2-one Openeye Name: 3-[1-(4-propylphenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(4-propylphenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(4-propylphenyl)ethylamino]azepan-2-one Traditional Name: 3-[1-(4-propylphenyl)ethylamino]azepan-2-one Formula: C17H26N2O MolecularWeight: 274.40114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C)NC2CCCCNC2=O

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C)NC2CCCCNC2=O

InChI

InChI=1S/C17H26N2O/c1-3-6-14-8-10-15(11-9-14)13(2)19-16-7-4-5-12-18-17(16)20/h8-11,13,16,19H,3-7,12H2,1-2H3,(H,18,20)