3-[(5-bromanyl-2-methyl-phenyl)amino]azepan-2-one

Systemtic Name: 3-[(5-bromanyl-2-methyl-phenyl)amino]azepan-2-one Openeye Name: 3-(5-bromo-2-methyl-anilino)azepan-2-one CAS Name: 3-(5-bromo-2-methylanilino)-2-azepanone IUPAC Name: 3-(5-bromo-2-methylanilino)azepan-2-one Traditional Name: 3-(5-bromo-2-methyl-anilino)azepan-2-one Formula: C13H17BrN2O MolecularWeight: 297.19088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Br)NC2CCCCNC2=O

Isomeric SMILES

CC1=C(C=C(C=C1)Br)NC2CCCCNC2=O

InChI

InChI=1S/C13H17BrN2O/c1-9-5-6-10(14)8-12(9)16-11-4-2-3-7-15-13(11)17/h5-6,8,11,16H,2-4,7H2,1H3,(H,15,17)