4-[(4-fluorophenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[(4-fluorophenyl)-(2-oxidanyl-4-oxidanylidene-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[(4-fluorophenyl)-(2-hydroxy-4-oxo-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-pyrazol-3-one CAS Name: 4-[(4-fluorophenyl)-(2-hydroxy-4-oxo-1-benzopyran-3-yl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[(4-fluorophenyl)-(2-hydroxy-4-oxochromen-3-yl)methyl]-1,5-dimethyl-2-phenylpyrazol-3-one Traditional Name: 4-[(4-fluorophenyl)-(2-hydroxy-4-keto-chromen-3-yl)methyl]-1,5-dimethyl-2-phenyl-3-pyrazolin-3-one Formula: C27H21FN2O4 MolecularWeight: 456.465043

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=C(OC5=CC=CC=C5C4=O)O

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=CC=C(C=C3)F)C4=C(OC5=CC=CC=C5C4=O)O

InChI

InChI=1S/C27H21FN2O4/c1-16-22(26(32)30(29(16)2)19-8-4-3-5-9-19)23(17-12-14-18(28)15-13-17)24-25(31)20-10-6-7-11-21(20)34-27(24)33/h3-15,23,33H,1-2H3