3-[(E)-3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-[5-chloranyl-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-4-pyrazolyl]-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-[5-chloro-1-(4-fluorophenyl)-3-methylpyrazol-4-yl]prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-[5-chloro-1-(4-fluorophenyl)-3-methyl-pyrazol-4-yl]acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C19H14ClFN2O4 MolecularWeight: 388.776863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=C(N(N=C2C)C3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C19H14ClFN2O4/c1-10-9-16(25)17(19(26)27-10)15(24)8-7-14-11(2)22-23(18(14)20)13-5-3-12(21)4-6-13/h3-9,26H,1-2H3/b8-7+