(E)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-1-(4-morpholinophenyl)prop-2-en-1-one CAS Name: (E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-[4-(4-morpholinyl)phenyl]-2-propen-1-one IUPAC Name: (E)-3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-(4-morpholin-4-ylphenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)-1-(4-morpholinophenyl)prop-2-en-1-one Formula: C20H20N2O6 MolecularWeight: 384.3826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)[N+](=O)[O-])C=CC(=O)C2=CC=C(C=C2)N3CCOCC3

Isomeric SMILES

COC1=CC(=CC(=C1O)[N+](=O)[O-])/C=C/C(=O)C2=CC=C(C=C2)N3CCOCC3

InChI

InChI=1S/C20H20N2O6/c1-27-19-13-14(12-17(20(19)24)22(25)26)2-7-18(23)15-3-5-16(6-4-15)21-8-10-28-11-9-21/h2-7,12-13,24H,8-11H2,1H3/b7-2+