1-(azepan-1-yl)-2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-3-(4-bromophenyl)propane-1,3-dione

Systemtic Name: 1-(azepan-1-yl)-2-(5-bromanyl-2-oxidanylidene-pyridin-1-yl)-3-(4-bromophenyl)propane-1,3-dione Openeye Name: 1-(azepan-1-yl)-2-(5-bromo-2-oxo-1-pyridyl)-3-(4-bromophenyl)propane-1,3-dione CAS Name: 1-(1-azepanyl)-2-(5-bromo-2-oxo-1-pyridinyl)-3-(4-bromophenyl)propane-1,3-dione IUPAC Name: 1-(azepan-1-yl)-2-(5-bromo-2-oxopyridin-1-yl)-3-(4-bromophenyl)propane-1,3-dione Traditional Name: 1-(azepan-1-yl)-2-(5-bromo-2-keto-1-pyridyl)-3-(4-bromophenyl)propane-1,3-dione Formula: C20H20Br2N2O3 MolecularWeight: 496.1924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(C(=O)C2=CC=C(C=C2)Br)N3C=C(C=CC3=O)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C(C(=O)C2=CC=C(C=C2)Br)N3C=C(C=CC3=O)Br

InChI

InChI=1S/C20H20Br2N2O3/c21-15-7-5-14(6-8-15)19(26)18(24-13-16(22)9-10-17(24)25)20(27)23-11-3-1-2-4-12-23/h5-10,13,18H,1-4,11-12H2