(E)-3-(5-bromanyl-2-methoxy-phenyl)-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(5-bromanyl-2-methoxy-phenyl)-1-[4-(3-morpholin-4-yl-4-nitro-phenyl)piperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(5-bromo-2-methoxy-phenyl)-1-[4-(3-morpholino-4-nitro-phenyl)piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(5-bromo-2-methoxyphenyl)-1-[4-[3-(4-morpholinyl)-4-nitrophenyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-1-[4-(3-morpholin-4-yl-4-nitrophenyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(5-bromo-2-methoxy-phenyl)-1-[4-(3-morpholino-4-nitro-phenyl)piperazino]prop-2-en-1-one Formula: C24H27BrN4O5 MolecularWeight: 531.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=CC(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=C/C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C24H27BrN4O5/c1-33-23-6-3-19(25)16-18(23)2-7-24(30)28-10-8-26(9-11-28)20-4-5-21(29(31)32)22(17-20)27-12-14-34-15-13-27/h2-7,16-17H,8-15H2,1H3/b7-2+