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

Systemtic Name: 3-[1-(4-tert-butylphenyl)ethylamino]azepan-2-one Openeye Name: 3-[1-(4-tert-butylphenyl)ethylamino]azepan-2-one CAS Name: 3-[1-(4-tert-butylphenyl)ethylamino]-2-azepanone IUPAC Name: 3-[1-(4-tert-butylphenyl)ethylamino]azepan-2-one Traditional Name: 3-[1-(4-tert-butylphenyl)ethylamino]azepan-2-one Formula: C18H28N2O MolecularWeight: 288.42772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N2O/c1-13(20-16-7-5-6-12-19-17(16)21)14-8-10-15(11-9-14)18(2,3)4/h8-11,13,16,20H,5-7,12H2,1-4H3,(H,19,21)