(6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(methoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: (6-chloranyl-7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3-(methoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: (6-chloro-7-methyl-2-oxo-chromen-4-yl)methyl 3-(methoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(methoxymethyl)-2-benzofurancarboxylic acid (6-chloro-7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-methyl-2-oxochromen-4-yl)methyl 3-(methoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(methoxymethyl)coumarilic acid (6-chloro-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C22H17ClO6 MolecularWeight: 412.81978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=C(C4=CC=CC=C4O3)COC)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=C(C4=CC=CC=C4O3)COC)Cl

InChI

InChI=1S/C22H17ClO6/c1-12-7-19-15(9-17(12)23)13(8-20(24)28-19)10-27-22(25)21-16(11-26-2)14-5-3-4-6-18(14)29-21/h3-9H,10-11H2,1-2H3