6-[5-(4-fluorophenyl)-1-(furan-3-ylmethyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[5-(4-fluorophenyl)-1-(furan-3-ylmethyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[5-(4-fluorophenyl)-1-(3-furylmethyl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[5-(4-fluorophenyl)-1-(3-furanylmethyl)-3-methyl-4-pyrazolyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[5-(4-fluorophenyl)-1-(furan-3-ylmethyl)-3-methylpyrazol-4-yl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[5-(4-fluorophenyl)-1-(3-furfuryl)-3-methyl-pyrazol-4-yl]-4H-1,4-benzoxazin-3-one Formula: C23H18FN3O3 MolecularWeight: 403.405723

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC3=C(C=C2)OCC(=O)N3)C4=CC=C(C=C4)F)CC5=COC=C5

Isomeric SMILES

CC1=NN(C(=C1C2=CC3=C(C=C2)OCC(=O)N3)C4=CC=C(C=C4)F)CC5=COC=C5

InChI

InChI=1S/C23H18FN3O3/c1-14-22(17-4-7-20-19(10-17)25-21(28)13-30-20)23(16-2-5-18(24)6-3-16)27(26-14)11-15-8-9-29-12-15/h2-10,12H,11,13H2,1H3,(H,25,28)