methyl 3-chloranyl-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 3-chloranyl-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate Openeye Name: methyl 3-chloro-6-(3-pyridylmethoxy)benzothiophene-2-carboxylate CAS Name: 3-chloro-6-(3-pyridinylmethoxy)-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 3-chloro-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-6-(3-pyridylmethoxy)benzothiophene-2-carboxylic acid methyl ester Formula: C16H12ClNO3S MolecularWeight: 333.78938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(S1)C=C(C=C2)OCC3=CN=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=C(C2=C(S1)C=C(C=C2)OCC3=CN=CC=C3)Cl

InChI

InChI=1S/C16H12ClNO3S/c1-20-16(19)15-14(17)12-5-4-11(7-13(12)22-15)21-9-10-3-2-6-18-8-10/h2-8H,9H2,1H3