(7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-chromen-4-yl)methyl 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (7-methyl-2-oxo-chromen-4-yl)methyl 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylic acid (7-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxochromen-4-yl)methyl 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylic acid (2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C21H14Cl2O5S MolecularWeight: 449.30386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C4=C(S3)C(=C(C=C4)OC)Cl)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C4=C(S3)C(=C(C=C4)OC)Cl)Cl

InChI

InChI=1S/C21H14Cl2O5S/c1-10-3-4-12-11(8-16(24)28-15(12)7-10)9-27-21(25)20-17(22)13-5-6-14(26-2)18(23)19(13)29-20/h3-8H,9H2,1-2H3