(E)-3-(3-chloranyl-4-fluoranyl-phenyl)-1-(5-methyl-3-nitro-2-oxidanyl-phenyl)prop-2-en-1-one

Systemtic Name: (E)-3-(3-chloranyl-4-fluoranyl-phenyl)-1-(5-methyl-3-nitro-2-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-chloro-4-fluoro-phenyl)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(3-chloro-4-fluorophenyl)-1-(2-hydroxy-5-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(3-chloro-4-fluorophenyl)-1-(2-hydroxy-5-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-chloro-4-fluoro-phenyl)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C16H11ClFNO4 MolecularWeight: 335.714243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)C=CC2=CC(=C(C=C2)F)Cl)O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)/C=C/C2=CC(=C(C=C2)F)Cl)O)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClFNO4/c1-9-6-11(16(21)14(7-9)19(22)23)15(20)5-3-10-2-4-13(18)12(17)8-10/h2-8,21H,1H3/b5-3+