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

Systemtic Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-chloranyl-3-nitro-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-chloro-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-chloro-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-1-(4-chloro-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)-1-(4-chloro-3-nitro-phenyl)prop-2-en-1-one Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClNO5/c1-3-5-12-28-20-11-7-15(13-21(20)27-4-2)6-10-19(24)16-8-9-17(22)18(14-16)23(25)26/h6-11,13-14H,3-5,12H2,1-2H3/b10-6+