methyl 2-[8-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-chromen-7-yl]oxyethanoate

Systemtic Name: methyl 2-[8-methyl-4-oxidanylidene-3-(1-phenylpyrazol-4-yl)oxy-chromen-7-yl]oxyethanoate Openeye Name: methyl 2-[8-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)oxy-chromen-7-yl]oxyacetate CAS Name: 2-[[8-methyl-4-oxo-3-[(1-phenyl-4-pyrazolyl)oxy]-1-benzopyran-7-yl]oxy]acetic acid methyl ester IUPAC Name: methyl 2-[8-methyl-4-oxo-3-(1-phenylpyrazol-4-yl)oxychromen-7-yl]oxyacetate Traditional Name: 2-[4-keto-8-methyl-3-(1-phenylpyrazol-4-yl)oxy-chromen-7-yl]oxyacetic acid methyl ester Formula: C22H18N2O6 MolecularWeight: 406.38812

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)OCC(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H18N2O6/c1-14-18(28-13-20(25)27-2)9-8-17-21(26)19(12-29-22(14)17)30-16-10-23-24(11-16)15-6-4-3-5-7-15/h3-12H,13H2,1-2H3