methyl 3-[[2,4-bis(chloranyl)-5-fluoranyl-phenyl]methyl]-2-methyl-1-benzothiophene-5-carboxylate

Systemtic Name: methyl 3-[[2,4-bis(chloranyl)-5-fluoranyl-phenyl]methyl]-2-methyl-1-benzothiophene-5-carboxylate Openeye Name: methyl 3-[(2,4-dichloro-5-fluoro-phenyl)methyl]-2-methyl-benzothiophene-5-carboxylate CAS Name: 3-[(2,4-dichloro-5-fluorophenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylic acid methyl ester IUPAC Name: methyl 3-[(2,4-dichloro-5-fluorophenyl)methyl]-2-methyl-1-benzothiophene-5-carboxylate Traditional Name: 3-(2,4-dichloro-5-fluoro-benzyl)-2-methyl-benzothiophene-5-carboxylic acid methyl ester Formula: C18H13Cl2FO2S MolecularWeight: 383.264023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)CC3=CC(=C(C=C3Cl)Cl)F

Isomeric SMILES

CC1=C(C2=C(S1)C=CC(=C2)C(=O)OC)CC3=CC(=C(C=C3Cl)Cl)F

InChI

InChI=1S/C18H13Cl2FO2S/c1-9-12(6-11-7-16(21)15(20)8-14(11)19)13-5-10(18(22)23-2)3-4-17(13)24-9/h3-5,7-8H,6H2,1-2H3