methyl 7-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 7-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-benzothiophene-2-carboxylate Openeye Name: methyl 7-(4-chlorophenyl)-4-(4-methoxyphenyl)benzothiophene-2-carboxylate CAS Name: 7-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 7-(4-chlorophenyl)-4-(4-methoxyphenyl)-1-benzothiophene-2-carboxylate Traditional Name: 7-(4-chlorophenyl)-4-(4-methoxyphenyl)benzothiophene-2-carboxylic acid methyl ester Formula: C23H17ClO3S MolecularWeight: 408.89728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C=C(SC3=C(C=C2)C4=CC=C(C=C4)Cl)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C=C(SC3=C(C=C2)C4=CC=C(C=C4)Cl)C(=O)OC

InChI

InChI=1S/C23H17ClO3S/c1-26-17-9-5-14(6-10-17)18-11-12-19(15-3-7-16(24)8-4-15)22-20(18)13-21(28-22)23(25)27-2/h3-13H,1-2H3