[3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] furan-2-carboxylate

Systemtic Name: [3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl] furan-2-carboxylate Openeye Name: [3-(4-chlorophenyl)-6-hexyl-4-oxo-chromen-7-yl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [3-(4-chlorophenyl)-6-hexyl-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [3-(4-chlorophenyl)-6-hexyl-4-keto-chromen-7-yl] ester Formula: C26H23ClO5 MolecularWeight: 450.91082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=CO4

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OC(=O)C4=CC=CO4

InChI

InChI=1S/C26H23ClO5/c1-2-3-4-5-7-18-14-20-24(15-23(18)32-26(29)22-8-6-13-30-22)31-16-21(25(20)28)17-9-11-19(27)12-10-17/h6,8-16H,2-5,7H2,1H3