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

Systemtic Name: (4-bromophenyl)methyl 3,7-bis(chloranyl)-6-methoxy-1-benzothiophene-2-carboxylate Openeye Name: (4-bromophenyl)methyl 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylate CAS Name: 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl 3,7-dichloro-6-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3,7-dichloro-6-methoxy-benzothiophene-2-carboxylic acid (4-bromobenzyl) ester Formula: C17H11BrCl2O3S MolecularWeight: 446.14244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=C(S2)C(=O)OCC3=CC=C(C=C3)Br)Cl)Cl

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=C(S2)C(=O)OCC3=CC=C(C=C3)Br)Cl)Cl

InChI

InChI=1S/C17H11BrCl2O3S/c1-22-12-7-6-11-13(19)16(24-15(11)14(12)20)17(21)23-8-9-2-4-10(18)5-3-9/h2-7H,8H2,1H3