7-methoxy-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one

Systemtic Name: 7-methoxy-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one Openeye Name: 7-methoxy-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one CAS Name: 7-methoxy-8-methyl-3-[(1-phenyl-4-pyrazolyl)oxy]-2-(trifluoromethyl)-1-benzopyran-4-one IUPAC Name: 7-methoxy-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromen-4-one Traditional Name: 7-methoxy-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-2-(trifluoromethyl)chromone Formula: C21H15F3N2O4 MolecularWeight: 416.35001

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CN(N=C3)C4=CC=CC=C4)C(F)(F)F)OC

Isomeric SMILES

CC1=C(C=CC2=C1OC(=C(C2=O)OC3=CN(N=C3)C4=CC=CC=C4)C(F)(F)F)OC

InChI

InChI=1S/C21H15F3N2O4/c1-12-16(28-2)9-8-15-17(27)19(20(21(22,23)24)30-18(12)15)29-14-10-25-26(11-14)13-6-4-3-5-7-13/h3-11H,1-2H3