ethyl 5-pentanoyloxy-2-phenyl-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 5-pentanoyloxy-2-phenyl-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 5-pentanoyloxy-2-phenyl-benzo[g]benzofuran-3-carboxylate CAS Name: 5-(1-oxopentoxy)-2-phenyl-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-pentanoyloxy-2-phenylbenzo[g][1]benzofuran-3-carboxylate Traditional Name: 2-phenyl-5-valeryloxy-benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C26H24O5 MolecularWeight: 416.46576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)OC1=CC2=C(C3=CC=CC=C31)OC(=C2C(=O)OCC)C4=CC=CC=C4

Isomeric SMILES

CCCCC(=O)OC1=CC2=C(C3=CC=CC=C31)OC(=C2C(=O)OCC)C4=CC=CC=C4

InChI

InChI=1S/C26H24O5/c1-3-5-15-22(27)30-21-16-20-23(26(28)29-4-2)24(17-11-7-6-8-12-17)31-25(20)19-14-10-9-13-18(19)21/h6-14,16H,3-5,15H2,1-2H3