(E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)C2=CC(=C(C=C2)C)[N+](=O)[O-])OCC

InChI

InChI=1S/C22H25NO5/c1-4-6-13-28-21-12-9-17(14-22(21)27-5-2)8-11-20(24)18-10-7-16(3)19(15-18)23(25)26/h7-12,14-15H,4-6,13H2,1-3H3/b11-8+