[2-(2-chlorophenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 1-benzofuran-2-carboxylate

Systemtic Name: [2-(2-chlorophenyl)-6-methyl-4-oxidanylidene-chromen-3-yl] 1-benzofuran-2-carboxylate Openeye Name: [2-(2-chlorophenyl)-6-methyl-4-oxo-chromen-3-yl] benzofuran-2-carboxylate CAS Name: 2-benzofurancarboxylic acid [2-(2-chlorophenyl)-6-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(2-chlorophenyl)-6-methyl-4-oxochromen-3-yl] 1-benzofuran-2-carboxylate Traditional Name: coumarilic acid [2-(2-chlorophenyl)-4-keto-6-methyl-chromen-3-yl] ester Formula: C25H15ClO5 MolecularWeight: 430.8366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5Cl

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=C(C2=O)OC(=O)C3=CC4=CC=CC=C4O3)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H15ClO5/c1-14-10-11-20-17(12-14)22(27)24(23(30-20)16-7-3-4-8-18(16)26)31-25(28)21-13-15-6-2-5-9-19(15)29-21/h2-13H,1H3