[2-(2-chlorophenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 1-benzofuran-2-carboxylate

Systemtic Name: [2-(2-chlorophenyl)-5,7-dimethyl-4-oxidanylidene-chromen-3-yl] 1-benzofuran-2-carboxylate Openeye Name: [2-(2-chlorophenyl)-5,7-dimethyl-4-oxo-chromen-3-yl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [2-(2-chlorophenyl)-5,7-dimethyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(2-chlorophenyl)-5,7-dimethyl-4-oxochromen-3-yl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [2-(2-chlorophenyl)-4-keto-5,7-dimethyl-chromen-3-yl] ester Formula: C26H17ClO5 MolecularWeight: 444.86318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5Cl)C

Isomeric SMILES

CC1=CC(=C2C(=C1)OC(=C(C2=O)OC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5Cl)C

InChI

InChI=1S/C26H17ClO5/c1-14-11-15(2)22-20(12-14)31-24(17-8-4-5-9-18(17)27)25(23(22)28)32-26(29)21-13-16-7-3-6-10-19(16)30-21/h3-13H,1-2H3