O4-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(6-chloro-7-ethyl-2-oxochromen-4-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl] ester O1-methyl ester Formula: C21H17ClO6 MolecularWeight: 400.80908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C(=O)OC)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C(=O)OC)Cl

InChI

InChI=1S/C21H17ClO6/c1-3-12-8-18-16(10-17(12)22)15(9-19(23)28-18)11-27-21(25)14-6-4-13(5-7-14)20(24)26-2/h4-10H,3,11H2,1-2H3