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

Systemtic Name: (E)-3-(3-fluoranyl-4-methoxy-phenyl)-1-(5-methyl-3-nitro-2-oxidanyl-phenyl)prop-2-en-1-one Openeye Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)prop-2-en-1-one CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-(2-hydroxy-5-methyl-3-nitrophenyl)-2-propen-1-one IUPAC Name: (E)-3-(3-fluoro-4-methoxyphenyl)-1-(2-hydroxy-5-methyl-3-nitrophenyl)prop-2-en-1-one Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)-1-(2-hydroxy-5-methyl-3-nitro-phenyl)prop-2-en-1-one Formula: C17H14FNO5 MolecularWeight: 331.295163

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14FNO5/c1-10-7-12(17(21)14(8-10)19(22)23)15(20)5-3-11-4-6-16(24-2)13(18)9-11/h3-9,21H,1-2H3/b5-3+