(2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl pyridine-3-carboxylate

Systemtic Name: (2-ethoxycarbonyl-4-fluoranyl-1-benzothiophen-3-yl)methyl pyridine-3-carboxylate Openeye Name: (2-ethoxycarbonyl-4-fluoro-benzothiophen-3-yl)methyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl ester IUPAC Name: (2-ethoxycarbonyl-4-fluoro-1-benzothiophen-3-yl)methyl pyridine-3-carboxylate Traditional Name: nicotinic acid (2-carbethoxy-4-fluoro-benzothiophen-3-yl)methyl ester Formula: C18H14FNO4S MolecularWeight: 359.371463

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=C2S1)F)COC(=O)C3=CN=CC=C3

InChI

InChI=1S/C18H14FNO4S/c1-2-23-18(22)16-12(15-13(19)6-3-7-14(15)25-16)10-24-17(21)11-5-4-8-20-9-11/h3-9H,2,10H2,1H3