O2-methyl O3-phenyl 5-chloranyl-4,7-dimethyl-1-benzothiophene-2,3-dicarboxylate

Systemtic Name: O2-methyl O3-phenyl 5-chloranyl-4,7-dimethyl-1-benzothiophene-2,3-dicarboxylate Openeye Name: O2-methyl O3-phenyl 5-chloro-4,7-dimethyl-benzothiophene-2,3-dicarboxylate CAS Name: 5-chloro-4,7-dimethyl-1-benzothiophene-2,3-dicarboxylic acid O2-methyl ester O3-phenyl ester IUPAC Name: 2-O-methyl 3-O-phenyl 5-chloro-4,7-dimethyl-1-benzothiophene-2,3-dicarboxylate Traditional Name: 5-chloro-4,7-dimethyl-benzothiophene-2,3-dicarboxylic acid O2-methyl ester O3-phenyl ester Formula: C19H15ClO4S MolecularWeight: 374.838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1SC(=C2C(=O)OC3=CC=CC=C3)C(=O)OC)C)Cl

Isomeric SMILES

CC1=CC(=C(C2=C1SC(=C2C(=O)OC3=CC=CC=C3)C(=O)OC)C)Cl

InChI

InChI=1S/C19H15ClO4S/c1-10-9-13(20)11(2)14-15(17(19(22)23-3)25-16(10)14)18(21)24-12-7-5-4-6-8-12/h4-9H,1-3H3