[3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-phenoxybutanoate

Systemtic Name: [3-(2-ethylphenoxy)-4-oxidanylidene-chromen-7-yl] 4-phenoxybutanoate Openeye Name: [3-(2-ethylphenoxy)-4-oxo-chromen-7-yl] 4-phenoxybutanoate CAS Name: 4-phenoxybutanoic acid [3-(2-ethylphenoxy)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-ethylphenoxy)-4-oxochromen-7-yl] 4-phenoxybutanoate Traditional Name: 4-phenoxybutyric acid [3-(2-ethylphenoxy)-4-keto-chromen-7-yl] ester Formula: C27H24O6 MolecularWeight: 444.47586

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)CCCOC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OC(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C27H24O6/c1-2-19-9-6-7-12-23(19)33-25-18-31-24-17-21(14-15-22(24)27(25)29)32-26(28)13-8-16-30-20-10-4-3-5-11-20/h3-7,9-12,14-15,17-18H,2,8,13,16H2,1H3