ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]carbonylamino]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]amino]benzofuran-2-carboxylate CAS Name: 3-[[[1-(4-fluorophenyl)sulfonyl-3-piperidinyl]-oxomethyl]amino]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[1-(4-fluorophenyl)sulfonylpiperidine-3-carbonyl]amino]-1-benzofuran-2-carboxylate Traditional Name: 3-[[1-(4-fluorophenyl)sulfonylnipecotoyl]amino]coumarilic acid ethyl ester Formula: C23H23FN2O6S MolecularWeight: 474.501923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)NC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN2O6S/c1-2-31-23(28)21-20(18-7-3-4-8-19(18)32-21)25-22(27)15-6-5-13-26(14-15)33(29,30)17-11-9-16(24)10-12-17/h3-4,7-12,15H,2,5-6,13-14H2,1H3,(H,25,27)