3-[(E)-3-[4-(4-fluoranylphenoxy)-3-nitro-phenyl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-[4-(4-fluoranylphenoxy)-3-nitro-phenyl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-[4-(4-fluorophenoxy)-3-nitro-phenyl]prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-[4-(4-fluorophenoxy)-3-nitrophenyl]-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-[4-(4-fluorophenoxy)-3-nitrophenyl]prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-[4-(4-fluorophenoxy)-3-nitro-phenyl]acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C21H14FNO7 MolecularWeight: 411.336763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC(=C(C=C2)OC3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=C(C=C2)OC3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C21H14FNO7/c1-12-10-18(25)20(21(26)29-12)17(24)8-2-13-3-9-19(16(11-13)23(27)28)30-15-6-4-14(22)5-7-15/h2-11,26H,1H3/b8-2+