3-[(4-bromanyl-2-chloranyl-phenyl)amino]azepan-2-one

Systemtic Name: 3-[(4-bromanyl-2-chloranyl-phenyl)amino]azepan-2-one Openeye Name: 3-(4-bromo-2-chloro-anilino)azepan-2-one CAS Name: 3-(4-bromo-2-chloroanilino)-2-azepanone IUPAC Name: 3-(4-bromo-2-chloroanilino)azepan-2-one Traditional Name: 3-(4-bromo-2-chloro-anilino)azepan-2-one Formula: C12H14BrClN2O MolecularWeight: 317.60936

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C12H14BrClN2O/c13-8-4-5-10(9(14)7-8)16-11-3-1-2-6-15-12(11)17/h4-5,7,11,16H,1-3,6H2,(H,15,17)