[3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [3-(2-ethylphenoxy)-4-oxo-chromen-7-yl] 3-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-isoindolyl)propanoic acid [3-(2-ethylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethylphenoxy)-4-oxochromen-7-yl] 3-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: 3-phthalimidopropionic acid [3-(2-ethylphenoxy)-4-keto-chromen-7-yl] ester Formula: C28H21NO7 MolecularWeight: 483.46884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CCC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C28H21NO7/c1-2-17-7-3-6-10-22(17)36-24-16-34-23-15-18(11-12-21(23)26(24)31)35-25(30)13-14-29-27(32)19-8-4-5-9-20(19)28(29)33/h3-12,15-16H,2,13-14H2,1H3