(E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-isopentyloxy-3-methoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-(4-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-[3-methoxy-4-(3-methylbutoxy)phenyl]-1-(4-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-isoamoxy-3-methoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C22H25NO5 MolecularWeight: 383.4376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OCCC(C)C)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OCCC(C)C)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H25NO5/c1-15(2)11-12-28-21-10-7-17(13-22(21)27-4)6-9-20(24)18-8-5-16(3)19(14-18)23(25)26/h5-10,13-15H,11-12H2,1-4H3/b9-6+